[4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol

C15H29NO — CID 62526376

IUPAC[4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol
SMILESCC1CCC(NC2(CO)CCC(C)CC2)CC1
InChIInChI=1S/C15H29NO/c1-12-3-5-14(6-4-12)16-15(11-17)9-7-13(2)8-10-15/h12-14,16-17H,3-11H2,1-2H3
InChIKeyVAYYHLYLKKMZKZ-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.10
Rot. Bonds3

About [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol

[4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol (PubChem CID 62526376) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol
PubChem CID62526376
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name[4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol
SMILESCC1CCC(NC2(CO)CCC(C)CC2)CC1
InChIInChI=1S/C15H29NO/c1-12-3-5-14(6-4-12)16-15(11-17)9-7-13(2)8-10-15/h12-14,16-17H,3-11H2,1-2H3
InChIKeyVAYYHLYLKKMZKZ-UHFFFAOYSA-N
XLogP3.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol 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 [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol?
The IUPAC name of [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol (CID 62526376) is [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol.
What is the SMILES notation for [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol?
The canonical SMILES for [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol is CC1CCC(NC2(CO)CCC(C)CC2)CC1.
What is the InChIKey of [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol?
The InChIKey is VAYYHLYLKKMZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12-3-5-14(6-4-12)16-15(11-17)9-7-13(2)8-10-15/h12-14,16-17H,3-11H2,1-2H3.
What are the key properties of [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol?
[4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol has a molecular weight of 239.40 g/mol, XLogP of 3.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol is sourced from PubChem (CID 62526376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).