(3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide

C14H19ClN2O2 — CID 124589589

IUPAC(3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide
SMILESO=C(NC[C@@H](O)c1ccccc1Cl)[C@H]1CCCNC1
InChIInChI=1S/C14H19ClN2O2/c15-12-6-2-1-5-11(12)13(18)9-17-14(19)10-4-3-7-16-8-10/h1-2,5-6,10,13,16,18H,3-4,7-9H2,(H,17,19)/t10-,13+/m0/s1
InChIKeyHXMAHJBDPDOKRG-GXFFZTMASA-N
MW282.77 g/mol
LogP1.49
Rot. Bonds4

About (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide

(3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide (PubChem CID 124589589) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide
PubChem CID124589589
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name(3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide
SMILESO=C(NC[C@@H](O)c1ccccc1Cl)[C@H]1CCCNC1
InChIInChI=1S/C14H19ClN2O2/c15-12-6-2-1-5-11(12)13(18)9-17-14(19)10-4-3-7-16-8-10/h1-2,5-6,10,13,16,18H,3-4,7-9H2,(H,17,19)/t10-,13+/m0/s1
InChIKeyHXMAHJBDPDOKRG-GXFFZTMASA-N
XLogP1.49
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide 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

N-[2-(2,6-dichlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide
CID 154759784
N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119317160
N-[2-(2-chlorophenyl)-2-hydroxyethyl]morpholine-2-carboxamide;hydrochloride
CID 122148196
N-[1-(2-chlorophenyl)ethyl]piperidine-3-carboxamide
CID 61258238
N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]piperidine-3-carboxamide
CID 119287258
3-amino-N-[2-(2-chlorophenyl)-2-hydroxyethyl]cyclopentane-1-carboxamide
CID 154759854
N-[2-(4-tert-butylphenyl)-2-hydroxyethyl]piperidine-3-carboxamide
CID 119328668
(3S)-N-(2-hydroxy-2-thiophen-3-ylethyl)piperidine-3-carboxamide
CID 106435475
N-[2-(3-chlorophenoxy)propyl]piperidine-3-carboxamide;hydrochloride
CID 119336993
N-(3-methyl-2-phenylbutyl)piperidine-3-carboxamide
CID 119294119
N-[2-(2,6-dichlorophenyl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119302304
N-(4-hydroxy-2-phenylbutyl)piperidine-3-carboxamide
CID 119326534

Frequently Asked Questions

What is the IUPAC name of (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide?
The IUPAC name of (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide (CID 124589589) is (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide.
What is the SMILES notation for (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide?
The canonical SMILES for (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide is O=C(NC[C@@H](O)c1ccccc1Cl)[C@H]1CCCNC1.
What is the InChIKey of (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide?
The InChIKey is HXMAHJBDPDOKRG-GXFFZTMASA-N. The full InChI is InChI=1S/C14H19ClN2O2/c15-12-6-2-1-5-11(12)13(18)9-17-14(19)10-4-3-7-16-8-10/h1-2,5-6,10,13,16,18H,3-4,7-9H2,(H,17,19)/t10-,13+/m0/s1.
What are the key properties of (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide?
(3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 1.49, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide is sourced from PubChem (CID 124589589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).