(2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide

C16H30N2O — CID 61174275

IUPAC(2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide
SMILESCCC(C)[C@H](N)C(=O)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C16H30N2O/c1-3-12(2)15(17)16(19)18(14-9-10-14)11-13-7-5-4-6-8-13/h12-15H,3-11,17H2,1-2H3/t12?,15-/m0/s1
InChIKeyDILUVFFHLCJHCE-CVRLYYSRSA-N
MW266.43 g/mol
LogP2.93
Rot. Bonds6

About (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide

(2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide (PubChem CID 61174275) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide
PubChem CID61174275
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name(2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide
SMILESCCC(C)[C@H](N)C(=O)N(CC1CCCCC1)C1CC1
InChIInChI=1S/C16H30N2O/c1-3-12(2)15(17)16(19)18(14-9-10-14)11-13-7-5-4-6-8-13/h12-15H,3-11,17H2,1-2H3/t12?,15-/m0/s1
InChIKeyDILUVFFHLCJHCE-CVRLYYSRSA-N
XLogP2.93
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide 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-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide
CID 54873047
(2S,3S)-2-amino-N-(cyclohexylmethyl)-N,3-dimethylpentanamide
CID 61162838
2-amino-N-(cyclobutylmethyl)-N,3-dimethylpentanamide
CID 62862218
2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-4-methylpentanamide
CID 54872866
2-amino-N-(cyclobutylmethyl)-N-ethyl-3-methylpentanamide
CID 107398412
3-[[(2S,3S)-2-amino-3-methylpentanoyl]-cyclopropylamino]propanoic acid
CID 61161442
3-chloro-N-(cyclohexylmethyl)-N-cyclopropyl-2-methylpropanamide
CID 62728154
(2S,3S)-2-amino-N-(2-cyanoethyl)-N-cyclopropyl-3-methylpentanamide
CID 61157435
propyl N-(cyclohexylmethyl)-N-cyclopropylcarbamate
CID 112738754
(2S)-2-amino-N-cyclopropyl-N-[(4-ethylphenyl)methyl]-3-methylpentanamide
CID 61173219
(2S,3S)-2-amino-N-[(4-chlorophenyl)methyl]-N-cyclopropyl-3-methylpentanamide
CID 61163913
2-amino-N,3-dimethyl-N-[(1-methylpiperidin-3-yl)methyl]pentanamide
CID 119855609

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide?
The IUPAC name of (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide (CID 61174275) is (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide?
The canonical SMILES for (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide is CCC(C)[C@H](N)C(=O)N(CC1CCCCC1)C1CC1.
What is the InChIKey of (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide?
The InChIKey is DILUVFFHLCJHCE-CVRLYYSRSA-N. The full InChI is InChI=1S/C16H30N2O/c1-3-12(2)15(17)16(19)18(14-9-10-14)11-13-7-5-4-6-8-13/h12-15H,3-11,17H2,1-2H3/t12?,15-/m0/s1.
What are the key properties of (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide?
(2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide has a molecular weight of 266.43 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylpentanamide is sourced from PubChem (CID 61174275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).