2-amino-N-(2,2-dimethylcyclohexyl)pentanamide

C13H26N2O — CID 79877969

IUPAC2-amino-N-(2,2-dimethylcyclohexyl)pentanamide
SMILESCCCC(N)C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C13H26N2O/c1-4-7-10(14)12(16)15-11-8-5-6-9-13(11,2)3/h10-11H,4-9,14H2,1-3H3,(H,15,16)
InChIKeyHJHYZYWDWZOVIH-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.20
Rot. Bonds4

About 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide

2-amino-N-(2,2-dimethylcyclohexyl)pentanamide (PubChem CID 79877969) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide.

Molecular Properties

Compound Name2-amino-N-(2,2-dimethylcyclohexyl)pentanamide
PubChem CID79877969
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-amino-N-(2,2-dimethylcyclohexyl)pentanamide
SMILESCCCC(N)C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C13H26N2O/c1-4-7-10(14)12(16)15-11-8-5-6-9-13(11,2)3/h10-11H,4-9,14H2,1-3H3,(H,15,16)
InChIKeyHJHYZYWDWZOVIH-UHFFFAOYSA-N
XLogP2.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide
CID 79878292
(2S)-2-amino-N-(2,2-dimethylcyclopentyl)hexanamide
CID 103831777
4-amino-5-[(2,2-dimethylcyclohexyl)amino]-5-oxopentanoic acid
CID 79878132
2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide
CID 79878464
2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide
CID 79870952
N-(2,2-dimethylcyclopentyl)-2-(N'-hydroxycarbamimidoyl)pentanamide
CID 79872575
4-amino-N-(2,2-dimethylcyclohexyl)pentanamide;hydrochloride
CID 120562889
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 107570804
N-(2,2-dimethylcyclohexyl)-2-(N'-hydroxycarbamimidoyl)butanamide
CID 79872938
N-(2,2-dimethylcyclopentyl)-2-sulfanylbutanamide
CID 131177062
(2S)-2-amino-N-[(1R,2S)-2-methylcyclohexyl]pentanamide
CID 93255478
(2S)-2-amino-N-(2-methylcycloheptyl)pentanamide
CID 107569955

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide?
The IUPAC name of 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide (CID 79877969) is 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide.
What is the SMILES notation for 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide?
The canonical SMILES for 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide is CCCC(N)C(=O)NC1CCCCC1(C)C.
What is the InChIKey of 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide?
The InChIKey is HJHYZYWDWZOVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-7-10(14)12(16)15-11-8-5-6-9-13(11,2)3/h10-11H,4-9,14H2,1-3H3,(H,15,16).
What are the key properties of 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide?
2-amino-N-(2,2-dimethylcyclohexyl)pentanamide has a molecular weight of 226.36 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,2-dimethylcyclohexyl)pentanamide is sourced from PubChem (CID 79877969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).