3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide

C17H18N4O4S — CID 74249952

IUPAC3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1cccc(S(=O)(=O)NC2CCCNC2=O)c1
InChIInChI=1S/C17H18N4O4S/c22-16(20-13-5-2-8-18-11-13)12-4-1-6-14(10-12)26(24,25)21-15-7-3-9-19-17(15)23/h1-2,4-6,8,10-11,15,21H,3,7,9H2,(H,19,23)(H,20,22)
InChIKeyBQKIHNOGHLTBIM-UHFFFAOYSA-N
MW374.42 g/mol
LogP0.89
Rot. Bonds5

About 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide

3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide (PubChem CID 74249952) has the molecular formula C17H18N4O4S and a molecular weight of 374.42 g/mol. Its IUPAC name is 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide
PubChem CID74249952
Molecular FormulaC17H18N4O4S
Molecular Weight374.42 g/mol
Exact Mass374.10
IUPAC Name3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1cccc(S(=O)(=O)NC2CCCNC2=O)c1
InChIInChI=1S/C17H18N4O4S/c22-16(20-13-5-2-8-18-11-13)12-4-1-6-14(10-12)26(24,25)21-15-7-3-9-19-17(15)23/h1-2,4-6,8,10-11,15,21H,3,7,9H2,(H,19,23)(H,20,22)
InChIKeyBQKIHNOGHLTBIM-UHFFFAOYSA-N
XLogP0.89
TPSA117.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.42
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2-oxopiperidin-3-yl)sulfamoyl]benzoic acid
CID 62091993
3-[[(3S)-1,1-dioxothiolan-3-yl]sulfamoyl]-N-pyridin-3-ylbenzamide
CID 25329934
N-pyridin-3-yl-3-sulfamoylbenzamide
CID 164627954
3-piperidin-1-ylsulfonyl-N-pyridin-3-ylbenzamide
CID 812621
1-N,3-N-dipyridin-3-ylbenzene-1,3-dicarboxamide
CID 679756
3-(cyclopropylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700197
3-[1-(methylamino)ethyl]-N-(2-oxopiperidin-3-yl)benzenesulfonamide
CID 62093994
3-(diethylsulfamoyl)-N-(2-oxopiperidin-3-yl)benzamide
CID 51128604
3-(2,3-dihydroindol-1-ylsulfonyl)-N-pyridin-3-ylbenzamide
CID 2477308
3-[[3-(cyclohexylsulfamoyl)benzoyl]amino]benzoic acid
CID 1121769
3-(cycloheptylsulfamoyl)-N-(pyridin-3-ylmethyl)benzamide
CID 109064880
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 51162183

Frequently Asked Questions

What is the IUPAC name of 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide?
The IUPAC name of 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide (CID 74249952) is 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide is O=C(Nc1cccnc1)c1cccc(S(=O)(=O)NC2CCCNC2=O)c1.
What is the InChIKey of 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide?
The InChIKey is BQKIHNOGHLTBIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O4S/c22-16(20-13-5-2-8-18-11-13)12-4-1-6-14(10-12)26(24,25)21-15-7-3-9-19-17(15)23/h1-2,4-6,8,10-11,15,21H,3,7,9H2,(H,19,23)(H,20,22).
What are the key properties of 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide?
3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide has a molecular weight of 374.42 g/mol, XLogP of 0.89, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-oxopiperidin-3-yl)sulfamoyl]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 74249952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).