1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol

C15H19ClO — CID 64625455

IUPAC1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol
SMILESOC1(c2ccccc2Cl)CCCC(C2CC2)C1
InChIInChI=1S/C15H19ClO/c16-14-6-2-1-5-13(14)15(17)9-3-4-12(10-15)11-7-8-11/h1-2,5-6,11-12,17H,3-4,7-10H2
InChIKeyOSXSTTIYEDCJGC-UHFFFAOYSA-N
MW250.77 g/mol
LogP4.13
Rot. Bonds2

About 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol

1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol (PubChem CID 64625455) has the molecular formula C15H19ClO and a molecular weight of 250.77 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol
PubChem CID64625455
Molecular FormulaC15H19ClO
Molecular Weight250.77 g/mol
Exact Mass250.11
IUPAC Name1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol
SMILESOC1(c2ccccc2Cl)CCCC(C2CC2)C1
InChIInChI=1S/C15H19ClO/c16-14-6-2-1-5-13(14)15(17)9-3-4-12(10-15)11-7-8-11/h1-2,5-6,11-12,17H,3-4,7-10H2
InChIKeyOSXSTTIYEDCJGC-UHFFFAOYSA-N
XLogP4.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.77
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol?
The IUPAC name of 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol (CID 64625455) is 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol.
What is the SMILES notation for 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol?
The canonical SMILES for 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol is OC1(c2ccccc2Cl)CCCC(C2CC2)C1.
What is the InChIKey of 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol?
The InChIKey is OSXSTTIYEDCJGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClO/c16-14-6-2-1-5-13(14)15(17)9-3-4-12(10-15)11-7-8-11/h1-2,5-6,11-12,17H,3-4,7-10H2.
What are the key properties of 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol?
1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol has a molecular weight of 250.77 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-3-cyclopropylcyclohexan-1-ol is sourced from PubChem (CID 64625455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).