(3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone

C14H18ClNO2 — CID 126462062

IUPAC(3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone
SMILESO=C(c1cccc(Cl)c1)C1CCCN(CCO)C1
InChIInChI=1S/C14H18ClNO2/c15-13-5-1-3-11(9-13)14(18)12-4-2-6-16(10-12)7-8-17/h1,3,5,9,12,17H,2,4,6-8,10H2
InChIKeyXRZFZMMJHCOTTE-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.23
Rot. Bonds4

About (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone

(3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone (PubChem CID 126462062) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone.

Molecular Properties

Compound Name(3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone
PubChem CID126462062
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name(3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone
SMILESO=C(c1cccc(Cl)c1)C1CCCN(CCO)C1
InChIInChI=1S/C14H18ClNO2/c15-13-5-1-3-11(9-13)14(18)12-4-2-6-16(10-12)7-8-17/h1,3,5,9,12,17H,2,4,6-8,10H2
InChIKeyXRZFZMMJHCOTTE-UHFFFAOYSA-N
XLogP2.23
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-chlorophenyl)-[1-[(2,6-dimethoxyphenyl)methyl]piperidin-3-yl]methanone
CID 23723447
N-[4-[[(3S)-3-(3-chlorobenzoyl)piperidin-1-yl]methyl]phenyl]acetamide
CID 26405826
(3-chlorophenyl)-[(3R)-1-[(2,4,6-trimethoxyphenyl)methyl]piperidin-3-yl]methanone
CID 26324635
(3-chlorophenyl)-[(3S)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-3-yl]methanone
CID 42516135
(3-chlorophenyl)-[(3R)-1-[(3,4-dimethoxyphenyl)methyl]piperidin-3-yl]methanone
CID 42516133
CID 70315573
CID 70315573
(3-chlorophenyl)-[(3S)-1-[(3-ethoxy-2-hydroxyphenyl)methyl]piperidin-3-yl]methanone
CID 25298707
[(3S)-1-[(3-chloro-4-hydroxy-5-methoxyphenyl)methyl]piperidin-3-yl]-(3-chlorophenyl)methanone
CID 26328496
1-(3-chlorophenyl)-3-[3-(hydroxymethyl)piperidin-1-yl]propan-1-one
CID 62630181
(3-chlorophenyl)-[1-[(3-ethoxy-4-hydroxyphenyl)methyl]piperidin-3-yl]methanone
CID 45240140
(3-chlorophenyl)-[1-[(1-ethylbenzimidazol-2-yl)methyl]piperidin-3-yl]methanone
CID 45232932
(3R)-N-benzyl-3-(3-chlorobenzoyl)piperidine-1-carboxamide
CID 42462168

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone?
The IUPAC name of (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone (CID 126462062) is (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone.
What is the SMILES notation for (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone?
The canonical SMILES for (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone is O=C(c1cccc(Cl)c1)C1CCCN(CCO)C1.
What is the InChIKey of (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone?
The InChIKey is XRZFZMMJHCOTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c15-13-5-1-3-11(9-13)14(18)12-4-2-6-16(10-12)7-8-17/h1,3,5,9,12,17H,2,4,6-8,10H2.
What are the key properties of (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone?
(3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone has a molecular weight of 267.76 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-[1-(2-hydroxyethyl)piperidin-3-yl]methanone is sourced from PubChem (CID 126462062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).