N-butylformamide
AlkaPlorer ID: AK109814
Synonym: 'N-n-butylformamide'
IUPAC Name: N-butylformamide
Structure
SMILES: CCCCN=CO
InChI: InChI=1S/C5H11NO/c1-2-3-4-6-5-7/h5H,2-4H2,1H3,(H,6,7)
InChIKey: QQGNLKJAIVSNCO-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 101.14899999999996
TPSA？: 32.59
MolLogP？: 1.3728
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Equus caballus | Alcohol dehydrogenase | Ki | 16000.0 | nM | 10.1021/jm9707380 |
| Homo sapiens | Alcohol dehydrogenase alpha chain | Ki | 7200.0 | nM | 10.1021/jm9707380 |
| Homo sapiens | Alcohol dehydrogenase beta chain | Ki | 11000.0 | nM | 10.1021/jm9707380 |
| Homo sapiens | Alcohol dehydrogenase class II | Ki | 110000.0 | nM | 10.1021/jm9707380 |
| Homo sapiens | Alcohol dehydrogenase class IV | Ki | 30000.0 | nM | 10.1021/jm9707380 |
| Homo sapiens | Alcohol dehydrogenase gamma chain | Ki | 100000.0 | nM | 10.1021/jm9707380 |