Molecule

2-Methyl-1-propylamine; N-Formyl

AlkaPlorer ID: AK111116

Synonym: N-(2-Methylpropyl)formamide, N-Isobutylformamide

IUPAC Name: N-(2-methylpropyl)formamide

SMILES: CC(C)CN=CO

InChI: InChI=1S/C5H11NO/c1-5(2)3-6-4-7/h4-5H,3H2,1-2H3,(H,6,7)

InChIKey: XCTTVNSXEHWZBI-UHFFFAOYSA-N

PubChem CID: 221387

CAS: 5462-82-8

LOTUS: LTS0052590

COCONUT: CNP0473867

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NPAtlas: NPA028553

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Salinispora pacifica	Salinispora	Micromonosporaceae	Micromonosporales	Actinomycetes	Actinomycetota	None	Bacteria
Roseovarius pelophilus	Roseovarius	Roseobacteraceae	Rhodobacterales	Alphaproteobacteria	Pseudomonadota	None	Bacteria
Pseudoruegeria sp. SK021	Pseudoruegeria	Roseobacteraceae	Rhodobacterales	Alphaproteobacteria	Pseudomonadota	None	Bacteria
None	Pacifica	Velutinidae	Littorinimorpha	Gastropoda	Mollusca	Metazoa	Eukaryota

Molecule Weight: 101.14899999999996

TPSA？: 32.59

MolLogP？: 1.2287

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 0

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Equus caballus	Alcohol dehydrogenase	Ki	13000.0	nM	10.1021/jm9707380
Homo sapiens	Alcohol dehydrogenase alpha chain	Ki	5500.0	nM	10.1021/jm9707380
Homo sapiens	Alcohol dehydrogenase beta chain	Ki	26000.0	nM	10.1021/jm9707380
Homo sapiens	Alcohol dehydrogenase class II	Ki	340000.0	nM	10.1021/jm9707380
Homo sapiens	Alcohol dehydrogenase class IV	Ki	180000.0	nM	10.1021/jm9707380
Homo sapiens	Alcohol dehydrogenase gamma chain	Ki	54000.0	nM	10.1021/jm9707380