(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride

C13H27ClN2O — CID 119780580

IUPAC(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride
SMILESCC(C)C[C@H](N)C(=O)NCC1(C)CCCC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-10(2)8-11(14)12(16)15-9-13(3)6-4-5-7-13;/h10-11H,4-9,14H2,1-3H3,(H,15,16);1H/t11-;/m0./s1
InChIKeyWKDYNXFICWUGAY-MERQFXBCSA-N
MW262.82 g/mol
LogP2.48
Rot. Bonds5

About (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride

(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride (PubChem CID 119780580) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride
PubChem CID119780580
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC Name(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride
SMILESCC(C)C[C@H](N)C(=O)NCC1(C)CCCC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-10(2)8-11(14)12(16)15-9-13(3)6-4-5-7-13;/h10-11H,4-9,14H2,1-3H3,(H,15,16);1H/t11-;/m0./s1
InChIKeyWKDYNXFICWUGAY-MERQFXBCSA-N
XLogP2.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
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 (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]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-[(1,4-dimethylpiperidin-4-yl)methyl]-4-methylpentanamide
CID 107163870
(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798136
2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798125
1-[[[(2R)-2-amino-4-methylpentanoyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 104903843
(2S)-2-amino-4-methyl-N-[(1-propylcyclobutyl)methyl]pentanamide
CID 119821752
3-amino-2-methyl-N-[(1-methylcyclohexyl)methyl]butanamide
CID 103581061
(2S)-2-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-methylpentanamide;hydrochloride
CID 119812150
(2S)-2-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]-4-methylpentanamide;hydrochloride
CID 119820408
1-[[(2-amino-4-methylpentanoyl)amino]methyl]cyclopropane-1-carboxylic acid
CID 115450693
2-amino-N-[(1-methylcyclohexyl)methyl]hexanamide
CID 103832772
(2S)-2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-4-methylpentanamide;hydrochloride
CID 119820348
2-methyl-N-[(1-methylcyclobutyl)methyl]propanamide
CID 103737357

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride?
The IUPAC name of (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride (CID 119780580) is (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride.
What is the SMILES notation for (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride?
The canonical SMILES for (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride is CC(C)C[C@H](N)C(=O)NCC1(C)CCCC1.Cl.
What is the InChIKey of (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride?
The InChIKey is WKDYNXFICWUGAY-MERQFXBCSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-10(2)8-11(14)12(16)15-9-13(3)6-4-5-7-13;/h10-11H,4-9,14H2,1-3H3,(H,15,16);1H/t11-;/m0./s1.
What are the key properties of (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride?
(2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-4-methyl-N-[(1-methylcyclopentyl)methyl]pentanamide;hydrochloride is sourced from PubChem (CID 119780580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).