N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide

C11H14N4O3S — CID 62915805

IUPACN-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)Nc1cnoc1
InChIInChI=1S/C11H14N4O3S/c1-2-5-12-11-10(4-3-6-13-11)19(16,17)15-9-7-14-18-8-9/h3-4,6-8,15H,2,5H2,1H3,(H,12,13)
InChIKeyAXIFEFFWCDQCJF-UHFFFAOYSA-N
MW282.32 g/mol
LogP1.69
Rot. Bonds6

About N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide

N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide (PubChem CID 62915805) has the molecular formula C11H14N4O3S and a molecular weight of 282.32 g/mol. Its IUPAC name is N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide
PubChem CID62915805
Molecular FormulaC11H14N4O3S
Molecular Weight282.32 g/mol
Exact Mass282.08
IUPAC NameN-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)Nc1cnoc1
InChIInChI=1S/C11H14N4O3S/c1-2-5-12-11-10(4-3-6-13-11)19(16,17)15-9-7-14-18-8-9/h3-4,6-8,15H,2,5H2,1H3,(H,12,13)
InChIKeyAXIFEFFWCDQCJF-UHFFFAOYSA-N
XLogP1.69
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(methylamino)-N-(1,2-oxazol-4-yl)pyridine-3-sulfonamide
CID 55130880
N-(2-methyl-4-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 79233082
N-(3-methylphenyl)-2-(propylamino)pyridine-3-sulfonamide
CID 62149101
N-(3-chloro-2-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 103094788
N-(5-fluoro-2-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 65480888
N-(2-iodophenyl)-2-(propylamino)pyridine-3-sulfonamide
CID 62144258
2-(ethylamino)-N-pyridin-4-ylpyridine-3-sulfonamide
CID 62143000
N-(2,2-difluoroethyl)-2-(propylamino)pyridine-3-sulfonamide
CID 113304047
N-(1,2-oxazol-5-ylmethyl)-2-(propylamino)pyridine-3-sulfonamide
CID 106422776
N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide
CID 55044262
N-(4-methylpentyl)-2-(propylamino)pyridine-3-sulfonamide
CID 63003516
N-(5-methylhexan-2-yl)-2-(propylamino)pyridine-3-sulfonamide
CID 63925751

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide (CID 62915805) is N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide is CCCNc1ncccc1S(=O)(=O)Nc1cnoc1.
What is the InChIKey of N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide?
The InChIKey is AXIFEFFWCDQCJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O3S/c1-2-5-12-11-10(4-3-6-13-11)19(16,17)15-9-7-14-18-8-9/h3-4,6-8,15H,2,5H2,1H3,(H,12,13).
What are the key properties of N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide?
N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide has a molecular weight of 282.32 g/mol, XLogP of 1.69, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-4-yl)-2-(propylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62915805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).