(2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide

C19H23N3O3S — CID 25381432

IUPAC(2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide
SMILESCc1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C19H23N3O3S/c1-14-9-11-16(12-10-14)26(24,25)22-13-4-3-7-17(22)19(23)21-18-8-5-6-15(2)20-18/h5-6,8-12,17H,3-4,7,13H2,1-2H3,(H,20,21,23)/t17-/m0/s1
InChIKeyPIZOZLDLCYZWEB-KRWDZBQOSA-N
MW373.48 g/mol
LogP2.88
Rot. Bonds4

About (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide

(2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide (PubChem CID 25381432) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide
PubChem CID25381432
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC Name(2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide
SMILESCc1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccc(C)n2)cc1
InChIInChI=1S/C19H23N3O3S/c1-14-9-11-16(12-10-14)26(24,25)22-13-4-3-7-17(22)19(23)21-18-8-5-6-15(2)20-18/h5-6,8-12,17H,3-4,7,13H2,1-2H3,(H,20,21,23)/t17-/m0/s1
InChIKeyPIZOZLDLCYZWEB-KRWDZBQOSA-N
XLogP2.88
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(benzenesulfonyl)-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide
CID 46651644
N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide
CID 16826437
(2R)-N-(6-ethyl-2-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 53488267
(2R)-1-(5-chlorothiophen-2-yl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide
CID 41343401
(2R)-N-(4-acetamidophenyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide
CID 8701358
(2R)-N-(4-methylphenyl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
CID 1084740
(2S)-N-(3-chlorophenyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide
CID 8760667
(2S)-1-(4-methylphenyl)sulfonyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyrrolidine-2-carboxamide
CID 32947927
(2S)-N-(4-fluorophenyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide
CID 8744138
(2S)-1-(4-fluorophenyl)sulfonyl-N-(4-methylphenyl)piperidine-2-carboxamide
CID 92887637
1-[4-[(4-methylphenyl)carbamoylamino]phenyl]sulfonyl-N-pyridin-2-ylpyrrolidine-2-carboxamide
CID 159988634
(2S)-N-(3-chloro-2-methylphenyl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
CID 40972131

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide?
The IUPAC name of (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide (CID 25381432) is (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide.
What is the SMILES notation for (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide?
The canonical SMILES for (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide is Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccc(C)n2)cc1.
What is the InChIKey of (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide?
The InChIKey is PIZOZLDLCYZWEB-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-14-9-11-16(12-10-14)26(24,25)22-13-4-3-7-17(22)19(23)21-18-8-5-6-15(2)20-18/h5-6,8-12,17H,3-4,7,13H2,1-2H3,(H,20,21,23)/t17-/m0/s1.
What are the key properties of (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide?
(2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide has a molecular weight of 373.48 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(4-methylphenyl)sulfonyl-N-(6-methyl-2-pyridinyl)piperidine-2-carboxamide is sourced from PubChem (CID 25381432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).