1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol

C14H18ClNO — CID 167714005

IUPAC1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol
SMILESOC1CCN(C2(c3ccccc3Cl)CC2)CC1
InChIInChI=1S/C14H18ClNO/c15-13-4-2-1-3-12(13)14(7-8-14)16-9-5-11(17)6-10-16/h1-4,11,17H,5-10H2
InChIKeyGXCUHQGDXWVJQQ-UHFFFAOYSA-N
MW251.76 g/mol
LogP2.79
Rot. Bonds2

About 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol

1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol (PubChem CID 167714005) has the molecular formula C14H18ClNO and a molecular weight of 251.76 g/mol. Its IUPAC name is 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol
PubChem CID167714005
Molecular FormulaC14H18ClNO
Molecular Weight251.76 g/mol
Exact Mass251.11
IUPAC Name1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol
SMILESOC1CCN(C2(c3ccccc3Cl)CC2)CC1
InChIInChI=1S/C14H18ClNO/c15-13-4-2-1-3-12(13)14(7-8-14)16-9-5-11(17)6-10-16/h1-4,11,17H,5-10H2
InChIKeyGXCUHQGDXWVJQQ-UHFFFAOYSA-N
XLogP2.79
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.76
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol?
The IUPAC name of 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol (CID 167714005) is 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol.
What is the SMILES notation for 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol?
The canonical SMILES for 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol is OC1CCN(C2(c3ccccc3Cl)CC2)CC1.
What is the InChIKey of 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol?
The InChIKey is GXCUHQGDXWVJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO/c15-13-4-2-1-3-12(13)14(7-8-14)16-9-5-11(17)6-10-16/h1-4,11,17H,5-10H2.
What are the key properties of 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol?
1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol has a molecular weight of 251.76 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-chlorophenyl)cyclopropyl]piperidin-4-ol is sourced from PubChem (CID 167714005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).