4-(1-methylcyclopentyl)cyclohexan-1-ol

C12H22O — CID 69367175

IUPAC4-(1-methylcyclopentyl)cyclohexan-1-ol
SMILESCC1(C2CCC(O)CC2)CCCC1
InChIInChI=1S/C12H22O/c1-12(8-2-3-9-12)10-4-6-11(13)7-5-10/h10-11,13H,2-9H2,1H3
InChIKeyNEWDJHFYENGROR-UHFFFAOYSA-N
MW182.31 g/mol
LogP3.12
Rot. Bonds1

About 4-(1-methylcyclopentyl)cyclohexan-1-ol

4-(1-methylcyclopentyl)cyclohexan-1-ol (PubChem CID 69367175) has the molecular formula C12H22O and a molecular weight of 182.31 g/mol. Its IUPAC name is 4-(1-methylcyclopentyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(1-methylcyclopentyl)cyclohexan-1-ol
PubChem CID69367175
Molecular FormulaC12H22O
Molecular Weight182.31 g/mol
Exact Mass182.17
IUPAC Name4-(1-methylcyclopentyl)cyclohexan-1-ol
SMILESCC1(C2CCC(O)CC2)CCCC1
InChIInChI=1S/C12H22O/c1-12(8-2-3-9-12)10-4-6-11(13)7-5-10/h10-11,13H,2-9H2,1H3
InChIKeyNEWDJHFYENGROR-UHFFFAOYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methylcyclopentyl)cyclohexan-1-ol?
The IUPAC name of 4-(1-methylcyclopentyl)cyclohexan-1-ol (CID 69367175) is 4-(1-methylcyclopentyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(1-methylcyclopentyl)cyclohexan-1-ol?
The canonical SMILES for 4-(1-methylcyclopentyl)cyclohexan-1-ol is CC1(C2CCC(O)CC2)CCCC1.
What is the InChIKey of 4-(1-methylcyclopentyl)cyclohexan-1-ol?
The InChIKey is NEWDJHFYENGROR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O/c1-12(8-2-3-9-12)10-4-6-11(13)7-5-10/h10-11,13H,2-9H2,1H3.
What are the key properties of 4-(1-methylcyclopentyl)cyclohexan-1-ol?
4-(1-methylcyclopentyl)cyclohexan-1-ol has a molecular weight of 182.31 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylcyclopentyl)cyclohexan-1-ol is sourced from PubChem (CID 69367175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).