[1-(4-chlorophenyl)piperidin-3-yl]methanol

C12H16ClNO — CID 10013911

IUPAC[1-(4-chlorophenyl)piperidin-3-yl]methanol
SMILESOCC1CCCN(c2ccc(Cl)cc2)C1
InChIInChI=1S/C12H16ClNO/c13-11-3-5-12(6-4-11)14-7-1-2-10(8-14)9-15/h3-6,10,15H,1-2,7-9H2
InChIKeyQWZBHUGRDNZXMK-UHFFFAOYSA-N
MW225.72 g/mol
LogP2.55
Rot. Bonds2

About [1-(4-chlorophenyl)piperidin-3-yl]methanol

[1-(4-chlorophenyl)piperidin-3-yl]methanol (PubChem CID 10013911) has the molecular formula C12H16ClNO and a molecular weight of 225.72 g/mol. Its IUPAC name is [1-(4-chlorophenyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(4-chlorophenyl)piperidin-3-yl]methanol
PubChem CID10013911
Molecular FormulaC12H16ClNO
Molecular Weight225.72 g/mol
Exact Mass225.09
IUPAC Name[1-(4-chlorophenyl)piperidin-3-yl]methanol
SMILESOCC1CCCN(c2ccc(Cl)cc2)C1
InChIInChI=1S/C12H16ClNO/c13-11-3-5-12(6-4-11)14-7-1-2-10(8-14)9-15/h3-6,10,15H,1-2,7-9H2
InChIKeyQWZBHUGRDNZXMK-UHFFFAOYSA-N
XLogP2.55
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(4-chlorophenyl)piperidin-3-yl]methanol?
The IUPAC name of [1-(4-chlorophenyl)piperidin-3-yl]methanol (CID 10013911) is [1-(4-chlorophenyl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(4-chlorophenyl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(4-chlorophenyl)piperidin-3-yl]methanol is OCC1CCCN(c2ccc(Cl)cc2)C1.
What is the InChIKey of [1-(4-chlorophenyl)piperidin-3-yl]methanol?
The InChIKey is QWZBHUGRDNZXMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO/c13-11-3-5-12(6-4-11)14-7-1-2-10(8-14)9-15/h3-6,10,15H,1-2,7-9H2.
What are the key properties of [1-(4-chlorophenyl)piperidin-3-yl]methanol?
[1-(4-chlorophenyl)piperidin-3-yl]methanol has a molecular weight of 225.72 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chlorophenyl)piperidin-3-yl]methanol is sourced from PubChem (CID 10013911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).