2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride

C13H27ClN2O — CID 119264133

IUPAC2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NC1CCCC(C)C1C.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-4-6-11(14)13(16)15-12-8-5-7-9(2)10(12)3;/h9-12H,4-8,14H2,1-3H3,(H,15,16);1H
InChIKeyRQFWEKVYLLZROL-UHFFFAOYSA-N
MW262.82 g/mol
LogP2.48
Rot. Bonds4

About 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride

2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride (PubChem CID 119264133) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride
PubChem CID119264133
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC Name2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NC1CCCC(C)C1C.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-4-6-11(14)13(16)15-12-8-5-7-9(2)10(12)3;/h9-12H,4-8,14H2,1-3H3,(H,15,16);1H
InChIKeyRQFWEKVYLLZROL-UHFFFAOYSA-N
XLogP2.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.82
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-N-(2,3-dimethylcyclohexyl)butanamide
CID 79025321
(2S)-2-amino-N-[(1R,2S)-2-methylcyclohexyl]pentanamide
CID 93255478
(2S)-2-amino-N-(2-methylcycloheptyl)pentanamide
CID 107569955
2-amino-N-(2,3-dimethylcyclohexyl)-3-methoxypropanamide
CID 81082305
2-amino-N-(2-methylcyclopentyl)hexanamide
CID 63281748
2-amino-N-[2-(hydroxymethyl)cyclopentyl]pentanamide
CID 103796946
2-amino-N-(2-methylcyclopentyl)butanamide
CID 63281650
(2R)-2-amino-N-(2,4-dimethylcyclohexyl)pentanamide
CID 103796818
(2S)-2-amino-N-(2,4-dimethylcyclohexyl)pentanamide
CID 107569791
(2S)-2-amino-N-(2,3-dimethylcyclohexyl)-3-methylbutanamide
CID 61148874
(2R)-2-amino-N-(2-propan-2-ylcyclohexyl)pentanamide
CID 103796389
4-amino-5-[(2-methylcyclohexyl)amino]-5-oxopentanoic acid
CID 64895983

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride (CID 119264133) is 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride is CCCC(N)C(=O)NC1CCCC(C)C1C.Cl.
What is the InChIKey of 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride?
The InChIKey is RQFWEKVYLLZROL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-4-6-11(14)13(16)15-12-8-5-7-9(2)10(12)3;/h9-12H,4-8,14H2,1-3H3,(H,15,16);1H.
What are the key properties of 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride?
2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-dimethylcyclohexyl)pentanamide;hydrochloride is sourced from PubChem (CID 119264133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).