(2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide

C19H23N3O4S — CID 40645847

IUPAC(2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide
SMILESCOc1ccc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C)cc2)cn1
InChIInChI=1S/C19H23N3O4S/c1-14-6-9-16(10-7-14)27(24,25)22-12-4-3-5-17(22)19(23)21-15-8-11-18(26-2)20-13-15/h6-11,13,17H,3-5,12H2,1-2H3,(H,21,23)/t17-/m1/s1
InChIKeyDWMBROSLKFIODS-QGZVFWFLSA-N
MW389.48 g/mol
LogP2.58
Rot. Bonds5

About (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide

(2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide (PubChem CID 40645847) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide
PubChem CID40645847
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC Name(2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide
SMILESCOc1ccc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C)cc2)cn1
InChIInChI=1S/C19H23N3O4S/c1-14-6-9-16(10-7-14)27(24,25)22-12-4-3-5-17(22)19(23)21-15-8-11-18(26-2)20-13-15/h6-11,13,17H,3-5,12H2,1-2H3,(H,21,23)/t17-/m1/s1
InChIKeyDWMBROSLKFIODS-QGZVFWFLSA-N
XLogP2.58
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(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
(2R)-N-(6-methoxy-3-pyridinyl)-1-methylsulfonylpyrrolidine-2-carboxamide
CID 39898332
(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)-1-(4-methylphenyl)sulfonyl-N-quinolin-3-ylpiperidine-2-carboxamide
CID 25353300
N-[4-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide
CID 4534701
(2R)-N-(3-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
CID 40894588
1-(4-methylphenyl)sulfonyl-N-(4-methylsulfonylphenyl)pyrrolidine-2-carboxamide
CID 16827882
(2S)-1-(cyclohexanecarbonyl)-N-(6-methoxy-3-pyridinyl)pyrrolidine-2-carboxamide
CID 51951158
(2S)-1-(4-methylphenyl)sulfonyl-N-(4-piperidin-1-ylphenyl)pyrrolidine-2-carboxamide
CID 25408726
(2R)-N-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylpiperidine-2-carboxamide
CID 92865516

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide?
The IUPAC name of (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide (CID 40645847) is (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide?
The canonical SMILES for (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide is COc1ccc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C)cc2)cn1.
What is the InChIKey of (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide?
The InChIKey is DWMBROSLKFIODS-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-14-6-9-16(10-7-14)27(24,25)22-12-4-3-5-17(22)19(23)21-15-8-11-18(26-2)20-13-15/h6-11,13,17H,3-5,12H2,1-2H3,(H,21,23)/t17-/m1/s1.
What are the key properties of (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide?
(2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide has a molecular weight of 389.48 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide is sourced from PubChem (CID 40645847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).