(2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide

C11H15ClN2O — CID 66255891

IUPAC(2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide
SMILESCC[C@@H](N)C(=O)Nc1c(C)cccc1Cl
InChIInChI=1S/C11H15ClN2O/c1-3-9(13)11(15)14-10-7(2)5-4-6-8(10)12/h4-6,9H,3,13H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyAMCJQVKVUKXEDK-SECBINFHSA-N
MW226.71 g/mol
LogP2.32
Rot. Bonds3

About (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide

(2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide (PubChem CID 66255891) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide
PubChem CID66255891
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name(2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide
SMILESCC[C@@H](N)C(=O)Nc1c(C)cccc1Cl
InChIInChI=1S/C11H15ClN2O/c1-3-9(13)11(15)14-10-7(2)5-4-6-8(10)12/h4-6,9H,3,13H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyAMCJQVKVUKXEDK-SECBINFHSA-N
XLogP2.32
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide 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

2-amino-N-(2-chloro-6-methylphenyl)pentanamide
CID 66254750
2-amino-N-(2,6-dimethylphenyl)butanamide;hydrochloride
CID 12546861
(2S)-2-amino-N-(2-chloro-6-methylphenyl)hexanamide
CID 107145880
2-amino-N-(2-chloro-6-methylphenyl)-4-phenylbutanamide
CID 114928777
(2R)-2-amino-N-(2-chloro-6-methylphenyl)-3-(4-hydroxyphenyl)propanamide
CID 104905306
(2S)-2-amino-N-(2-chloro-6-methylphenyl)-3-methylbutanamide
CID 66254944
3-amino-N-(2-chloro-6-methylphenyl)butanamide;hydrochloride
CID 12546926
2-[[(2S)-butan-2-yl]amino]-N-(2-chloro-6-methylphenyl)acetamide
CID 124514697
2-(3-aminophenyl)-N-(2-chloro-6-methylphenyl)propanamide
CID 106591588
2-amino-3-(2-chloro-6-methylanilino)propanoic acid
CID 103256039
(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
CID 107570747
(2S)-2-amino-N-(6-chloro-8-methylquinolin-5-yl)butanamide
CID 79024943

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide?
The IUPAC name of (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide (CID 66255891) is (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide.
What is the SMILES notation for (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide?
The canonical SMILES for (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide is CC[C@@H](N)C(=O)Nc1c(C)cccc1Cl.
What is the InChIKey of (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide?
The InChIKey is AMCJQVKVUKXEDK-SECBINFHSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-3-9(13)11(15)14-10-7(2)5-4-6-8(10)12/h4-6,9H,3,13H2,1-2H3,(H,14,15)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide?
(2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide has a molecular weight of 226.71 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-chloro-6-methylphenyl)butanamide is sourced from PubChem (CID 66255891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).