4-amino-N-methylhexanamide

C7H16N2O — CID 118906510

IUPAC4-amino-N-methylhexanamide
SMILESCCC(N)CCC(=O)NC
InChIInChI=1S/C7H16N2O/c1-3-6(8)4-5-7(10)9-2/h6H,3-5,8H2,1-2H3,(H,9,10)
InChIKeyXZJCWNSVWISMNM-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.25
Rot. Bonds4

About 4-amino-N-methylhexanamide

4-amino-N-methylhexanamide (PubChem CID 118906510) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 4-amino-N-methylhexanamide.

Molecular Properties

Compound Name4-amino-N-methylhexanamide
PubChem CID118906510
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name4-amino-N-methylhexanamide
SMILESCCC(N)CCC(=O)NC
InChIInChI=1S/C7H16N2O/c1-3-6(8)4-5-7(10)9-2/h6H,3-5,8H2,1-2H3,(H,9,10)
InChIKeyXZJCWNSVWISMNM-UHFFFAOYSA-N
XLogP0.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N,5-dimethylhexanamide
CID 102537827
methyl (4S)-4-aminohexanoate
CID 130019319
4-(2-aminobutylsulfinyl)-N-methylbutanamide
CID 81189749
N',2-dimethylpentanediamide
CID 21268064
aminomethyl (2S)-2-amino-5-(methylamino)-5-oxopentanoate
CID 88729241
N-(2-aminobutyl)-4-methylpentanamide
CID 63730752
3-(3-aminobutylsulfonyl)-N-methylpropanamide
CID 81193833
2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
CID 103810328
4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
CID 106813309
3-amino-9-methyldecan-5-one
CID 116609077
6-methylhept-6-en-3-amine
CID 89243580
(3R)-3-amino-N-methylbutanamide;hydrochloride
CID 87931451

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-methylhexanamide?
The IUPAC name of 4-amino-N-methylhexanamide (CID 118906510) is 4-amino-N-methylhexanamide.
What is the SMILES notation for 4-amino-N-methylhexanamide?
The canonical SMILES for 4-amino-N-methylhexanamide is CCC(N)CCC(=O)NC.
What is the InChIKey of 4-amino-N-methylhexanamide?
The InChIKey is XZJCWNSVWISMNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-3-6(8)4-5-7(10)9-2/h6H,3-5,8H2,1-2H3,(H,9,10).
What are the key properties of 4-amino-N-methylhexanamide?
4-amino-N-methylhexanamide has a molecular weight of 144.22 g/mol, XLogP of 0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-methylhexanamide is sourced from PubChem (CID 118906510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).