(3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide

C15H29NO2 — CID 54411501

IUPAC(3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide
SMILESCC[C@H](O)C(C(=O)NCC(C)C)C1CCCCC1
InChIInChI=1S/C15H29NO2/c1-4-13(17)14(12-8-6-5-7-9-12)15(18)16-10-11(2)3/h11-14,17H,4-10H2,1-3H3,(H,16,18)/t13-,14?/m0/s1
InChIKeyVULUECCPZBQENJ-LSLKUGRBSA-N
MW255.40 g/mol
LogP2.73
Rot. Bonds6

About (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide

(3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide (PubChem CID 54411501) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide.

Molecular Properties

Compound Name(3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide
PubChem CID54411501
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name(3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide
SMILESCC[C@H](O)C(C(=O)NCC(C)C)C1CCCCC1
InChIInChI=1S/C15H29NO2/c1-4-13(17)14(12-8-6-5-7-9-12)15(18)16-10-11(2)3/h11-14,17H,4-10H2,1-3H3,(H,16,18)/t13-,14?/m0/s1
InChIKeyVULUECCPZBQENJ-LSLKUGRBSA-N
XLogP2.73
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide?
The IUPAC name of (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide (CID 54411501) is (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide.
What is the SMILES notation for (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide?
The canonical SMILES for (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide is CC[C@H](O)C(C(=O)NCC(C)C)C1CCCCC1.
What is the InChIKey of (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide?
The InChIKey is VULUECCPZBQENJ-LSLKUGRBSA-N. The full InChI is InChI=1S/C15H29NO2/c1-4-13(17)14(12-8-6-5-7-9-12)15(18)16-10-11(2)3/h11-14,17H,4-10H2,1-3H3,(H,16,18)/t13-,14?/m0/s1.
What are the key properties of (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide?
(3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide has a molecular weight of 255.40 g/mol, XLogP of 2.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2-cyclohexyl-3-hydroxy-N-(2-methylpropyl)pentanamide is sourced from PubChem (CID 54411501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).