1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol

C13H24O — CID 64775324

IUPAC1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol
SMILESCC1CCC(CCC(O)C2CC2)CC1
InChIInChI=1S/C13H24O/c1-10-2-4-11(5-3-10)6-9-13(14)12-7-8-12/h10-14H,2-9H2,1H3
InChIKeyBDIYUYLLFXSMKG-UHFFFAOYSA-N
MW196.33 g/mol
LogP3.36
Rot. Bonds4

About 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol

1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol (PubChem CID 64775324) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol.

Molecular Properties

Compound Name1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol
PubChem CID64775324
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol
SMILESCC1CCC(CCC(O)C2CC2)CC1
InChIInChI=1S/C13H24O/c1-10-2-4-11(5-3-10)6-9-13(14)12-7-8-12/h10-14H,2-9H2,1H3
InChIKeyBDIYUYLLFXSMKG-UHFFFAOYSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol?
The IUPAC name of 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol (CID 64775324) is 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol.
What is the SMILES notation for 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol?
The canonical SMILES for 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol is CC1CCC(CCC(O)C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol?
The InChIKey is BDIYUYLLFXSMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-10-2-4-11(5-3-10)6-9-13(14)12-7-8-12/h10-14H,2-9H2,1H3.
What are the key properties of 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol?
1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol has a molecular weight of 196.33 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(4-methylcyclohexyl)propan-1-ol is sourced from PubChem (CID 64775324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).