1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol

C11H22O — CID 22561619

IUPAC1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCCC(C)(O)C1C
InChIInChI=1S/C11H22O/c1-8(2)10-6-5-7-11(4,12)9(10)3/h8-10,12H,5-7H2,1-4H3
InChIKeyPVFCULSWWLHXLU-UHFFFAOYSA-N
MW170.30 g/mol
LogP2.83
Rot. Bonds1

About 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol

1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol (PubChem CID 22561619) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol
PubChem CID22561619
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCCC(C)(O)C1C
InChIInChI=1S/C11H22O/c1-8(2)10-6-5-7-11(4,12)9(10)3/h8-10,12H,5-7H2,1-4H3
InChIKeyPVFCULSWWLHXLU-UHFFFAOYSA-N
XLogP2.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cis-(1R,2R)-1-methyl-2-propan-2-ylcyclopentan-1-ol
CID 158874958
1-[(1R,2S,6R)-2-hydroxy-2-methyl-6-propan-2-ylcyclohexyl]-2-methylpropan-1-one
CID 135081225
trans-(1R,2S)-1,2-dimethylcyclopentan-1-ol
CID 13057535
(1S,2R,3S)-3-hydroxy-2,3-dimethylcyclohexane-1-carbonitrile
CID 11686937
1,1-dimethyl-3,4-di(propan-2-yl)cycloheptane
CID 166560829
cis-(1S,2S)-1-methyl-2-propan-2-ylcyclopentane
CID 59954464
4a,8-dimethyl-2-propan-2-yl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-1-ol
CID 74931871
1,2,3-trimethylcyclopentan-1-ol
CID 23077337
(1S,2S,3R)-1-ethenyl-1-methyl-3-propan-2-yl-2-prop-1-en-2-ylcyclohexane
CID 163017053
(1S)-1,2-di(propan-2-yl)cyclopentane
CID 161356354
trans-(1R,2S)-2-chloro-1-methylcyclopentan-1-ol
CID 131071734
[(1R,2R)-2-hydroxy-2-methylcyclopentyl]azanium
CID 171460673

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol (CID 22561619) is 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol is CC(C)C1CCCC(C)(O)C1C.
What is the InChIKey of 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol?
The InChIKey is PVFCULSWWLHXLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-8(2)10-6-5-7-11(4,12)9(10)3/h8-10,12H,5-7H2,1-4H3.
What are the key properties of 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol?
1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol has a molecular weight of 170.30 g/mol, XLogP of 2.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 22561619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).