4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol

C16H25NO — CID 12711968

IUPAC4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol
SMILESCc1ccc(C2(N(C)C)CCC(C)(O)CC2)cc1
InChIInChI=1S/C16H25NO/c1-13-5-7-14(8-6-13)16(17(3)4)11-9-15(2,18)10-12-16/h5-8,18H,9-12H2,1-4H3
InChIKeyKCWDGUPOLDCWQM-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.08
Rot. Bonds2

About 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol

4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol (PubChem CID 12711968) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol
PubChem CID12711968
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol
SMILESCc1ccc(C2(N(C)C)CCC(C)(O)CC2)cc1
InChIInChI=1S/C16H25NO/c1-13-5-7-14(8-6-13)16(17(3)4)11-9-15(2,18)10-12-16/h5-8,18H,9-12H2,1-4H3
InChIKeyKCWDGUPOLDCWQM-UHFFFAOYSA-N
XLogP3.08
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol 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-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol?
The IUPAC name of 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol (CID 12711968) is 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol?
The canonical SMILES for 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol is Cc1ccc(C2(N(C)C)CCC(C)(O)CC2)cc1.
What is the InChIKey of 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol?
The InChIKey is KCWDGUPOLDCWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-13-5-7-14(8-6-13)16(17(3)4)11-9-15(2,18)10-12-16/h5-8,18H,9-12H2,1-4H3.
What are the key properties of 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol?
4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol has a molecular weight of 247.38 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-1-methyl-4-(4-methylphenyl)cyclohexan-1-ol is sourced from PubChem (CID 12711968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).