1-(2-methylpropyl)cyclohexan-1-ol

C10H20O — CID 11116304

IUPAC1-(2-methylpropyl)cyclohexan-1-ol
SMILESCC(C)CC1(O)CCCCC1
InChIInChI=1S/C10H20O/c1-9(2)8-10(11)6-4-3-5-7-10/h9,11H,3-8H2,1-2H3
InChIKeyBJROFNGVAGISIW-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.73
Rot. Bonds2

About 1-(2-methylpropyl)cyclohexan-1-ol

1-(2-methylpropyl)cyclohexan-1-ol (PubChem CID 11116304) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-(2-methylpropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(2-methylpropyl)cyclohexan-1-ol
PubChem CID11116304
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name1-(2-methylpropyl)cyclohexan-1-ol
SMILESCC(C)CC1(O)CCCCC1
InChIInChI=1S/C10H20O/c1-9(2)8-10(11)6-4-3-5-7-10/h9,11H,3-8H2,1-2H3
InChIKeyBJROFNGVAGISIW-UHFFFAOYSA-N
XLogP2.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)cyclohexan-1-ol?
The IUPAC name of 1-(2-methylpropyl)cyclohexan-1-ol (CID 11116304) is 1-(2-methylpropyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(2-methylpropyl)cyclohexan-1-ol?
The canonical SMILES for 1-(2-methylpropyl)cyclohexan-1-ol is CC(C)CC1(O)CCCCC1.
What is the InChIKey of 1-(2-methylpropyl)cyclohexan-1-ol?
The InChIKey is BJROFNGVAGISIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-9(2)8-10(11)6-4-3-5-7-10/h9,11H,3-8H2,1-2H3.
What are the key properties of 1-(2-methylpropyl)cyclohexan-1-ol?
1-(2-methylpropyl)cyclohexan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)cyclohexan-1-ol is sourced from PubChem (CID 11116304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).