(3,4-dimethylcyclohexyl)-phenylmethanol

C15H22O — CID 64740008

IUPAC(3,4-dimethylcyclohexyl)-phenylmethanol
SMILESCC1CCC(C(O)c2ccccc2)CC1C
InChIInChI=1S/C15H22O/c1-11-8-9-14(10-12(11)2)15(16)13-6-4-3-5-7-13/h3-7,11-12,14-16H,8-10H2,1-2H3
InChIKeyNYPVMSYTCSXFIJ-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.79
Rot. Bonds2

About (3,4-dimethylcyclohexyl)-phenylmethanol

(3,4-dimethylcyclohexyl)-phenylmethanol (PubChem CID 64740008) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is (3,4-dimethylcyclohexyl)-phenylmethanol.

Molecular Properties

Compound Name(3,4-dimethylcyclohexyl)-phenylmethanol
PubChem CID64740008
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name(3,4-dimethylcyclohexyl)-phenylmethanol
SMILESCC1CCC(C(O)c2ccccc2)CC1C
InChIInChI=1S/C15H22O/c1-11-8-9-14(10-12(11)2)15(16)13-6-4-3-5-7-13/h3-7,11-12,14-16H,8-10H2,1-2H3
InChIKeyNYPVMSYTCSXFIJ-UHFFFAOYSA-N
XLogP3.79
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3,4-dimethylcyclohexyl)-(3-methylphenyl)methanol
CID 64739613
3-[(3,4-dimethylcyclohexyl)-hydroxymethyl]benzonitrile
CID 113318860
(3,4-dimethylcyclohexyl)-(2-iodophenyl)methanol
CID 115806226
(3,5-dichlorophenyl)-(3,4-dimethylcyclohexyl)methanol
CID 64739213
(3,5-dimethylcyclohexyl)-phenylmethanol
CID 64730076
(3,4-dimethylcyclohexyl)-(2,6-dimethyl-4-pyridinyl)methanol
CID 107502825
2,3-dihydro-1H-inden-5-yl-(3,4-dimethylcyclohexyl)methanol
CID 115806114
(S)-cyclopentyl(phenyl)methanol
CID 36691435
(R)-cyclopentyl(phenyl)methanol
CID 38988779
1,3-benzodioxol-5-yl-(3,4-dimethylcyclohexyl)methanol
CID 64738404
1-(3,4-dimethylcyclohexyl)-2-(2-fluorophenyl)sulfanylethanol
CID 66053257
2-(3,4-dimethylcyclohexyl)-1-phenylethanol
CID 79423892

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylcyclohexyl)-phenylmethanol?
The IUPAC name of (3,4-dimethylcyclohexyl)-phenylmethanol (CID 64740008) is (3,4-dimethylcyclohexyl)-phenylmethanol.
What is the SMILES notation for (3,4-dimethylcyclohexyl)-phenylmethanol?
The canonical SMILES for (3,4-dimethylcyclohexyl)-phenylmethanol is CC1CCC(C(O)c2ccccc2)CC1C.
What is the InChIKey of (3,4-dimethylcyclohexyl)-phenylmethanol?
The InChIKey is NYPVMSYTCSXFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-11-8-9-14(10-12(11)2)15(16)13-6-4-3-5-7-13/h3-7,11-12,14-16H,8-10H2,1-2H3.
What are the key properties of (3,4-dimethylcyclohexyl)-phenylmethanol?
(3,4-dimethylcyclohexyl)-phenylmethanol has a molecular weight of 218.34 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylcyclohexyl)-phenylmethanol is sourced from PubChem (CID 64740008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).