N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide

C10H19NO2 — CID 167220472

IUPACN-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide
SMILESCC(=O)N(C)C1CCC(C)(O)CC1
InChIInChI=1S/C10H19NO2/c1-8(12)11(3)9-4-6-10(2,13)7-5-9/h9,13H,4-7H2,1-3H3
InChIKeyQAYQRYDVJNEWID-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.16
Rot. Bonds1

About N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide

N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide (PubChem CID 167220472) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide
PubChem CID167220472
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide
SMILESCC(=O)N(C)C1CCC(C)(O)CC1
InChIInChI=1S/C10H19NO2/c1-8(12)11(3)9-4-6-10(2,13)7-5-9/h9,13H,4-7H2,1-3H3
InChIKeyQAYQRYDVJNEWID-UHFFFAOYSA-N
XLogP1.16
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide 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-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide?
The IUPAC name of N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide (CID 167220472) is N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide.
What is the SMILES notation for N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide?
The canonical SMILES for N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide is CC(=O)N(C)C1CCC(C)(O)CC1.
What is the InChIKey of N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide?
The InChIKey is QAYQRYDVJNEWID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8(12)11(3)9-4-6-10(2,13)7-5-9/h9,13H,4-7H2,1-3H3.
What are the key properties of N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide?
N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide has a molecular weight of 185.27 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-4-methylcyclohexyl)-N-methylacetamide is sourced from PubChem (CID 167220472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).