(3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide

C19H21ClN4O4S — CID 41063292

IUPAC(3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide
SMILESO=C(CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1)Nc1ccccn1
InChIInChI=1S/C19H21ClN4O4S/c20-15-6-8-16(9-7-15)29(27,28)24-11-3-4-14(13-24)19(26)22-12-18(25)23-17-5-1-2-10-21-17/h1-2,5-10,14H,3-4,11-13H2,(H,22,26)(H,21,23,25)/t14-/m1/s1
InChIKeyKLZOXINPFXLGIU-CQSZACIVSA-N
MW436.92 g/mol
LogP1.89
Rot. Bonds6

About (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide

(3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide (PubChem CID 41063292) has the molecular formula C19H21ClN4O4S and a molecular weight of 436.92 g/mol. Its IUPAC name is (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide
PubChem CID41063292
Molecular FormulaC19H21ClN4O4S
Molecular Weight436.92 g/mol
Exact Mass436.10
IUPAC Name(3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide
SMILESO=C(CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1)Nc1ccccn1
InChIInChI=1S/C19H21ClN4O4S/c20-15-6-8-16(9-7-15)29(27,28)24-11-3-4-14(13-24)19(26)22-12-18(25)23-17-5-1-2-10-21-17/h1-2,5-10,14H,3-4,11-13H2,(H,22,26)(H,21,23,25)/t14-/m1/s1
InChIKeyKLZOXINPFXLGIU-CQSZACIVSA-N
XLogP1.89
TPSA108.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.92
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]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

(3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-4-ylmethylamino)ethyl]piperidine-3-carboxamide
CID 41064753
1-(4-chlorophenyl)sulfonyl-N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide
CID 43042605
1-(4-chlorophenyl)sulfonyl-N-[(2-fluorophenyl)methyl]piperidine-3-carboxamide
CID 24636962
N-(4-chlorophenyl)-1-(4-chlorophenyl)sulfonylpiperidine-3-carboxamide
CID 16862472
1-(4-chlorophenyl)sulfonyl-N-(cyclohexylmethyl)piperidine-3-carboxamide
CID 3214745
1-(benzenesulfonyl)-N-(4-chlorophenyl)piperidine-3-carboxamide
CID 16862471
(3R)-1-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 41118580
(3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]piperidine-3-carboxamide
CID 40917187
(3R)-1-(4-chlorophenyl)sulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-3-carboxamide
CID 100673677
1-(4-fluorophenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 2969235
(3R)-N-[3-(2-chlorophenyl)propyl]-1-(4-chlorophenyl)sulfonylpiperidine-3-carboxamide
CID 100675499
(3S)-N-(4-chloro-2-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide
CID 30156165

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide (CID 41063292) is (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide is O=C(CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1)Nc1ccccn1.
What is the InChIKey of (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide?
The InChIKey is KLZOXINPFXLGIU-CQSZACIVSA-N. The full InChI is InChI=1S/C19H21ClN4O4S/c20-15-6-8-16(9-7-15)29(27,28)24-11-3-4-14(13-24)19(26)22-12-18(25)23-17-5-1-2-10-21-17/h1-2,5-10,14H,3-4,11-13H2,(H,22,26)(H,21,23,25)/t14-/m1/s1.
What are the key properties of (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide?
(3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide has a molecular weight of 436.92 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(4-chlorophenyl)sulfonyl-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 41063292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).