6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide

C19H19N5O3S — CID 129202557

IUPAC6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide
SMILESCCNS(=O)(=O)c1ccc(-c2cnc(N)c(-c3ccc(C(N)=O)cn3)c2)cc1
InChIInChI=1S/C19H19N5O3S/c1-2-24-28(26,27)15-6-3-12(4-7-15)14-9-16(18(20)23-11-14)17-8-5-13(10-22-17)19(21)25/h3-11,24H,2H2,1H3,(H2,20,23)(H2,21,25)
InChIKeyRJRJEZAWVRHQEU-UHFFFAOYSA-N
MW397.46 g/mol
LogP1.79
Rot. Bonds6

About 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide

6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide (PubChem CID 129202557) has the molecular formula C19H19N5O3S and a molecular weight of 397.46 g/mol. Its IUPAC name is 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide
PubChem CID129202557
Molecular FormulaC19H19N5O3S
Molecular Weight397.46 g/mol
Exact Mass397.12
IUPAC Name6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide
SMILESCCNS(=O)(=O)c1ccc(-c2cnc(N)c(-c3ccc(C(N)=O)cn3)c2)cc1
InChIInChI=1S/C19H19N5O3S/c1-2-24-28(26,27)15-6-3-12(4-7-15)14-9-16(18(20)23-11-14)17-8-5-13(10-22-17)19(21)25/h3-11,24H,2H2,1H3,(H2,20,23)(H2,21,25)
InChIKeyRJRJEZAWVRHQEU-UHFFFAOYSA-N
XLogP1.79
TPSA141.06 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.46
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide (CID 129202557) is 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide is CCNS(=O)(=O)c1ccc(-c2cnc(N)c(-c3ccc(C(N)=O)cn3)c2)cc1.
What is the InChIKey of 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide?
The InChIKey is RJRJEZAWVRHQEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O3S/c1-2-24-28(26,27)15-6-3-12(4-7-15)14-9-16(18(20)23-11-14)17-8-5-13(10-22-17)19(21)25/h3-11,24H,2H2,1H3,(H2,20,23)(H2,21,25).
What are the key properties of 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide?
6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide has a molecular weight of 397.46 g/mol, XLogP of 1.79, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-amino-5-[4-(ethylsulfamoyl)phenyl]-3-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 129202557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).