2-Methylaniline; N-Ac
AlkaPlorer ID: AK054621
Synonym: N-(2-Methylphenyl)acetamide, Acet-o-toluidide
IUPAC Name: N-(2-methylphenyl)acetamide
Structure
SMILES: CC(=O)NC1=CC=CC=C1C
InChI: InChI=1S/C9H11NO/c1-7-5-3-4-6-9(7)10-8(2)11/h3-6H,1-2H3,(H,10,11)
InChIKey: BPEXTIMJLDWDTL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Limonia | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Rosa transmorrisonensis | Rosa | Rosaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Hypholoma capnoides | Hypholoma | Strophariaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 149.19299999999996
TPSA？: 29.1
MolLogP？: 1.95342
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | 15-hydroxyprostaglandin dehydrogenase [NAD+] | Potency | 8912.5 | nM | None |
| Homo sapiens | Aldehyde dehydrogenase 1A1 | Potency | 39810.7 | nM | None |
| Homo sapiens | ATPase family AAA domain-containing protein 5 | Potency | 9196.2 | nM | None |
| Homo sapiens | Chromobox protein homolog 1 | Potency | 100000.0 | nM | None |
| Homo sapiens | DNA polymerase iota | Potency | 89125.1 | nM | None |
| Homo sapiens | Geminin | Potency | 5.2 | nM | None |
| Homo sapiens | Geminin | Potency | 3662.6 | nM | None |
| Plasmodium falciparum | Plasmodium falciparum | Potency | 11689.1 | nM | None |
| None | No relevant target | LogD7.4 | 1.0 | None | 10.6019/CHEMBL3301361 |
| None | Unchecked | Potency | 461.1 | nM | None |
| None | Unchecked | Potency | 2818.4 | nM | None |
| None | Unchecked | Potency | 7943.3 | nM | None |