2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide

C17H15N5O3S — CID 71080374

IUPAC2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide
SMILESNc1ncc(-c2cccc(S(N)(=O)=O)c2)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C17H15N5O3S/c18-16-15(17(23)22-13-4-6-20-7-5-13)9-12(10-21-16)11-2-1-3-14(8-11)26(19,24)25/h1-10H,(H2,18,21)(H2,19,24,25)(H,20,22,23)
InChIKeyXIXUGUKTZKBHOE-UHFFFAOYSA-N
MW369.41 g/mol
LogP1.63
Rot. Bonds4

About 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide

2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide (PubChem CID 71080374) has the molecular formula C17H15N5O3S and a molecular weight of 369.41 g/mol. Its IUPAC name is 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide
PubChem CID71080374
Molecular FormulaC17H15N5O3S
Molecular Weight369.41 g/mol
Exact Mass369.09
IUPAC Name2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide
SMILESNc1ncc(-c2cccc(S(N)(=O)=O)c2)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C17H15N5O3S/c18-16-15(17(23)22-13-4-6-20-7-5-13)9-12(10-21-16)11-2-1-3-14(8-11)26(19,24)25/h1-10H,(H2,18,21)(H2,19,24,25)(H,20,22,23)
InChIKeyXIXUGUKTZKBHOE-UHFFFAOYSA-N
XLogP1.63
TPSA141.06 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.41
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-5-[3-(4-hydroxypiperidin-1-yl)sulfonylphenyl]-N-pyridin-4-ylpyridine-3-carboxamide
CID 71061133
[4-[6-amino-5-(pyridin-4-ylcarbamoyl)-3-pyridinyl]phenyl] formate
CID 174791748
2-amino-5-(1-carbamoyl-1-methylpyrazol-1-ium-4-yl)-N-pyridin-4-ylpyridine-3-carboxamide
CID 123201906
methyl 4-[6-amino-5-(pyridin-4-ylcarbamoyl)-3-pyridinyl]-2-fluorobenzoate
CID 71060843
ethyl 4-[6-amino-5-(pyridin-4-ylcarbamoyl)-3-pyridinyl]benzoate
CID 71061208
2-amino-5-[4-[bis(2-hydroxyethyl)carbamoyl]phenyl]-N-pyridin-4-ylpyridine-3-carboxamide
CID 71061213
2-methyl-N-(3-sulfamoylphenyl)pyridine-3-carboxamide
CID 78950909
5-amino-N-(3-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
CID 43337194
3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide
CID 105064331
2-amino-5-[5-(morpholin-4-ylmethyl)thiophen-3-yl]-N-pyridin-4-ylpyridine-3-carboxamide
CID 71061217
N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide
CID 164524580
2-amino-5-(1,5-dihydroimidazo[1,2-a]pyridin-2-yl)-N-pyridin-4-ylpyridine-3-carboxamide
CID 71062414

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide (CID 71080374) is 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide is Nc1ncc(-c2cccc(S(N)(=O)=O)c2)cc1C(=O)Nc1ccncc1.
What is the InChIKey of 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide?
The InChIKey is XIXUGUKTZKBHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O3S/c18-16-15(17(23)22-13-4-6-20-7-5-13)9-12(10-21-16)11-2-1-3-14(8-11)26(19,24)25/h1-10H,(H2,18,21)(H2,19,24,25)(H,20,22,23).
What are the key properties of 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide?
2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide has a molecular weight of 369.41 g/mol, XLogP of 1.63, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-pyridin-4-yl-5-(3-sulfamoylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 71080374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).