N-cyclohexyl-2-hydroxy-3-methylbutanamide

C11H21NO2 — CID 101272726

IUPACN-cyclohexyl-2-hydroxy-3-methylbutanamide
SMILESCC(C)C(O)C(=O)NC1CCCCC1
InChIInChI=1S/C11H21NO2/c1-8(2)10(13)11(14)12-9-6-4-3-5-7-9/h8-10,13H,3-7H2,1-2H3,(H,12,14)
InChIKeySMBCRDQBPKLRHL-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.45
Rot. Bonds3

About N-cyclohexyl-2-hydroxy-3-methylbutanamide

N-cyclohexyl-2-hydroxy-3-methylbutanamide (PubChem CID 101272726) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-cyclohexyl-2-hydroxy-3-methylbutanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-hydroxy-3-methylbutanamide
PubChem CID101272726
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-cyclohexyl-2-hydroxy-3-methylbutanamide
SMILESCC(C)C(O)C(=O)NC1CCCCC1
InChIInChI=1S/C11H21NO2/c1-8(2)10(13)11(14)12-9-6-4-3-5-7-9/h8-10,13H,3-7H2,1-2H3,(H,12,14)
InChIKeySMBCRDQBPKLRHL-UHFFFAOYSA-N
XLogP1.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-cyclohexyl-2-hydroxy-3-methylbutanamide 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 N-cyclohexyl-2-hydroxy-3-methylbutanamide?
The IUPAC name of N-cyclohexyl-2-hydroxy-3-methylbutanamide (CID 101272726) is N-cyclohexyl-2-hydroxy-3-methylbutanamide.
What is the SMILES notation for N-cyclohexyl-2-hydroxy-3-methylbutanamide?
The canonical SMILES for N-cyclohexyl-2-hydroxy-3-methylbutanamide is CC(C)C(O)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-hydroxy-3-methylbutanamide?
The InChIKey is SMBCRDQBPKLRHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-8(2)10(13)11(14)12-9-6-4-3-5-7-9/h8-10,13H,3-7H2,1-2H3,(H,12,14).
What are the key properties of N-cyclohexyl-2-hydroxy-3-methylbutanamide?
N-cyclohexyl-2-hydroxy-3-methylbutanamide has a molecular weight of 199.29 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-hydroxy-3-methylbutanamide is sourced from PubChem (CID 101272726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).