5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide

C9H10N4O3S — CID 63719383

IUPAC5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCCS(N)(=O)=O)nc1
InChIInChI=1S/C9H10N4O3S/c10-5-7-1-2-8(13-6-7)9(14)12-3-4-17(11,15)16/h1-2,6H,3-4H2,(H,12,14)(H2,11,15,16)
InChIKeyKEZJBCMUDNNDOO-UHFFFAOYSA-N
MW254.27 g/mol
LogP-1.03
Rot. Bonds4

About 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide

5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide (PubChem CID 63719383) has the molecular formula C9H10N4O3S and a molecular weight of 254.27 g/mol. Its IUPAC name is 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide
PubChem CID63719383
Molecular FormulaC9H10N4O3S
Molecular Weight254.27 g/mol
Exact Mass254.05
IUPAC Name5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCCS(N)(=O)=O)nc1
InChIInChI=1S/C9H10N4O3S/c10-5-7-1-2-8(13-6-7)9(14)12-3-4-17(11,15)16/h1-2,6H,3-4H2,(H,12,14)(H2,11,15,16)
InChIKeyKEZJBCMUDNNDOO-UHFFFAOYSA-N
XLogP-1.03
TPSA125.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.27
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-cyano-N-(3-methylsulfonylpropyl)pyridine-2-carboxamide
CID 63716783
N-(5-amino-5-oxopentyl)-5-cyanopyridine-2-carboxamide
CID 103896383
5-cyano-N-(3-iodopropyl)pyridine-2-carboxamide
CID 114504454
(2S)-4-[(5-cyanopyridine-2-carbonyl)amino]-2-hydroxybutanoic acid
CID 107834949
5-cyano-N-(2-propan-2-yloxyethyl)pyridine-2-carboxamide
CID 104578528
2-[(5-cyano-2-pyridinyl)amino]ethanesulfonamide
CID 43552431
5-cyano-N-prop-2-ynylpyridine-2-carboxamide
CID 63717306
5-cyano-N-(3-propoxypropyl)pyridine-2-carboxamide
CID 82942469
5-cyano-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
CID 63722909
5-cyano-N-(4-hydroxypentyl)pyridine-2-carboxamide
CID 107300157
N-but-2-ynyl-5-cyanopyridine-2-carboxamide
CID 115866853
5-amino-N-(2-sulfamoylethyl)pyrazine-2-carboxamide
CID 107374558

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The IUPAC name of 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide (CID 63719383) is 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide is N#Cc1ccc(C(=O)NCCS(N)(=O)=O)nc1.
What is the InChIKey of 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
The InChIKey is KEZJBCMUDNNDOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O3S/c10-5-7-1-2-8(13-6-7)9(14)12-3-4-17(11,15)16/h1-2,6H,3-4H2,(H,12,14)(H2,11,15,16).
What are the key properties of 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide?
5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide has a molecular weight of 254.27 g/mol, XLogP of -1.03, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-(2-sulfamoylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 63719383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).