cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol

C14H20O — CID 21153344

IUPACcis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol
SMILESCc1ccccc1[C@]1(O)CCCC[C@@H]1C
InChIInChI=1S/C14H20O/c1-11-7-3-4-9-13(11)14(15)10-6-5-8-12(14)2/h3-4,7,9,12,15H,5-6,8,10H2,1-2H3/t12-,14-/m0/s1
InChIKeyPHDHMKBEBBKGJV-JSGCOSHPSA-N
MW204.31 g/mol
LogP3.39
Rot. Bonds1

About cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol

cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol (PubChem CID 21153344) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol
PubChem CID21153344
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Namecis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol
SMILESCc1ccccc1[C@]1(O)CCCC[C@@H]1C
InChIInChI=1S/C14H20O/c1-11-7-3-4-9-13(11)14(15)10-6-5-8-12(14)2/h3-4,7,9,12,15H,5-6,8,10H2,1-2H3/t12-,14-/m0/s1
InChIKeyPHDHMKBEBBKGJV-JSGCOSHPSA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclohexyl-1-(2-methylphenyl)cyclohexan-1-ol
CID 60794929
(1R)-2-methyl-1-(2-methylphenyl)cyclohexan-1-amine
CID 156552436
trans-(1S,2S)-2-(2,2-dimethylhydrazinyl)-1-(2-methylphenyl)cyclohexan-1-ol
CID 102137500
1-(5-fluoro-2-methylphenyl)-2-methylcyclopentan-1-ol
CID 65049665
N-methyl-1-[(1R)-2-methyl-1-(2-methylphenyl)cyclohexyl]methanimine
CID 156552608
cis-(1R,2R)-2-methyl-1-phenylcyclopentan-1-ol
CID 12611391
2-methyl-1-[2-methyl-4-(trifluoromethyl)phenyl]cyclopentan-1-ol
CID 102751617
(1S)-N-ethyl-2-methyl-1-(2-methylphenyl)cyclohexan-1-amine
CID 156552487
trans-(1R,2S)-1-[2-(ethylamino)phenyl]-2-methylcyclopentan-1-ol
CID 14320166
2-methyl-1-[2-(trifluoromethoxy)phenyl]cyclopentan-1-ol
CID 65050039
2-methyl-1-(2-propoxyphenyl)cyclopentan-1-ol
CID 104658757
(3R,4R)-1,4-dimethyl-3-(2-methylphenyl)pyrrolidin-3-ol
CID 125426094

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol?
The IUPAC name of cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol (CID 21153344) is cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol.
What is the SMILES notation for cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol?
The canonical SMILES for cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol is Cc1ccccc1[C@]1(O)CCCC[C@@H]1C.
What is the InChIKey of cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol?
The InChIKey is PHDHMKBEBBKGJV-JSGCOSHPSA-N. The full InChI is InChI=1S/C14H20O/c1-11-7-3-4-9-13(11)14(15)10-6-5-8-12(14)2/h3-4,7,9,12,15H,5-6,8,10H2,1-2H3/t12-,14-/m0/s1.
What are the key properties of cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol?
cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.39, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2S)-2-methyl-1-(2-methylphenyl)cyclohexan-1-ol is sourced from PubChem (CID 21153344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).