4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide

C9H6ClN3O2 — CID 45497358

IUPAC4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide
SMILESO=C(Nc1ccon1)c1cc(Cl)ccn1
InChIInChI=1S/C9H6ClN3O2/c10-6-1-3-11-7(5-6)9(14)12-8-2-4-15-13-8/h1-5H,(H,12,13,14)
InChIKeyZLCNDJACGTYRDJ-UHFFFAOYSA-N
MW223.62 g/mol
LogP1.98
Rot. Bonds2

About 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide

4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide (PubChem CID 45497358) has the molecular formula C9H6ClN3O2 and a molecular weight of 223.62 g/mol. Its IUPAC name is 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide
PubChem CID45497358
Molecular FormulaC9H6ClN3O2
Molecular Weight223.62 g/mol
Exact Mass223.01
IUPAC Name4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide
SMILESO=C(Nc1ccon1)c1cc(Cl)ccn1
InChIInChI=1S/C9H6ClN3O2/c10-6-1-3-11-7(5-6)9(14)12-8-2-4-15-13-8/h1-5H,(H,12,13,14)
InChIKeyZLCNDJACGTYRDJ-UHFFFAOYSA-N
XLogP1.98
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.62
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dichloro-N-(1,2-oxazol-3-yl)benzamide
CID 17249127
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CID 44634187
4-chloro-N-hydroxypyridine-2-carboxamide
CID 83381234
4-chloro-N-pyridazin-3-ylpyridine-2-carboxamide
CID 115635761
4-chloro-N-[2-[(4-chloropyridine-2-carbonyl)amino]phenyl]pyridine-2-carboxamide
CID 102274363
N-(5-bromo-2-pyridinyl)-4-chloropyridine-2-carboxamide
CID 43111935
5-chloro-N-(1,2-oxazol-3-yl)-1,3,4-thiadiazole-2-carboxamide
CID 80618798
(4-chloropyridine-2-carbonyl)carbamic acid
CID 174620541
4-chloro-N-(2,3,4,5,6-pentafluorophenyl)pyridine-2-carboxamide
CID 115279672
4-chloro-N-(5-chloro-2-fluorophenyl)pyridine-2-carboxamide
CID 43385379
4-chloro-N-quinoxalin-6-ylpyridine-2-carboxamide
CID 47254903
N-(5-bromo-4-methyl-2-pyridinyl)-4-chloropyridine-2-carboxamide
CID 79734317

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide (CID 45497358) is 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide is O=C(Nc1ccon1)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide?
The InChIKey is ZLCNDJACGTYRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClN3O2/c10-6-1-3-11-7(5-6)9(14)12-8-2-4-15-13-8/h1-5H,(H,12,13,14).
What are the key properties of 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide?
4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide has a molecular weight of 223.62 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(1,2-oxazol-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 45497358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).