(3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol

C16H24O — CID 64739613

IUPAC(3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol
SMILESCc1cccc(C(O)C2CCC(C)C(C)C2)c1
InChIInChI=1S/C16H24O/c1-11-5-4-6-14(9-11)16(17)15-8-7-12(2)13(3)10-15/h4-6,9,12-13,15-17H,7-8,10H2,1-3H3
InChIKeyYPOAEAGPKZCONK-UHFFFAOYSA-N
MW232.37 g/mol
LogP4.10
Rot. Bonds2

About (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol

(3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol (PubChem CID 64739613) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol.

Molecular Properties

Compound Name(3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol
PubChem CID64739613
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Name(3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol
SMILESCc1cccc(C(O)C2CCC(C)C(C)C2)c1
InChIInChI=1S/C16H24O/c1-11-5-4-6-14(9-11)16(17)15-8-7-12(2)13(3)10-15/h4-6,9,12-13,15-17H,7-8,10H2,1-3H3
InChIKeyYPOAEAGPKZCONK-UHFFFAOYSA-N
XLogP4.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3,4-dimethylcyclohexyl)-phenylmethanol
CID 64740008
3-[(3,4-dimethylcyclohexyl)-hydroxymethyl]benzonitrile
CID 113318860
(4-tert-butylcyclohexyl)-(3-methylphenyl)methanol
CID 65400122
(3,4-dimethylcyclohexyl)-(2,6-dimethyl-4-pyridinyl)methanol
CID 107502825
2,3-dihydro-1H-inden-5-yl-(3,4-dimethylcyclohexyl)methanol
CID 115806114
(3,5-dichlorophenyl)-(3,4-dimethylcyclohexyl)methanol
CID 64739213
1,3-benzodioxol-5-yl-(3,4-dimethylcyclohexyl)methanol
CID 64738404
(4-butylcyclohexyl)-(3-methylphenyl)methanol
CID 114978020
(3,4-dimethylcyclohexyl)-(3,5-dimethylphenyl)methanamine
CID 104989109
(S)-cyclopropyl-(3-methylphenyl)methanamine;hydrochloride
CID 171229489
2-cyclopropyl-2-(3-methylphenyl)ethanol
CID 104819581
(R)-(3-methylphenyl)-[(2R)-oxiran-2-yl]methanol
CID 130810989

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol?
The IUPAC name of (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol (CID 64739613) is (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol.
What is the SMILES notation for (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol?
The canonical SMILES for (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol is Cc1cccc(C(O)C2CCC(C)C(C)C2)c1.
What is the InChIKey of (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol?
The InChIKey is YPOAEAGPKZCONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O/c1-11-5-4-6-14(9-11)16(17)15-8-7-12(2)13(3)10-15/h4-6,9,12-13,15-17H,7-8,10H2,1-3H3.
What are the key properties of (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol?
(3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol has a molecular weight of 232.37 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol is sourced from PubChem (CID 64739613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).