3-chloro-N-(1,2-oxazol-3-yl)benzamide

C10H7ClN2O2 — CID 1247464

IUPAC3-chloro-N-(1,2-oxazol-3-yl)benzamide
SMILESO=C(Nc1ccon1)c1cccc(Cl)c1
InChIInChI=1S/C10H7ClN2O2/c11-8-3-1-2-7(6-8)10(14)12-9-4-5-15-13-9/h1-6H,(H,12,13,14)
InChIKeyYMDSPAORQHWBQI-UHFFFAOYSA-N
MW222.63 g/mol
LogP2.58
Rot. Bonds2

About 3-chloro-N-(1,2-oxazol-3-yl)benzamide

3-chloro-N-(1,2-oxazol-3-yl)benzamide (PubChem CID 1247464) has the molecular formula C10H7ClN2O2 and a molecular weight of 222.63 g/mol. Its IUPAC name is 3-chloro-N-(1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(1,2-oxazol-3-yl)benzamide
PubChem CID1247464
Molecular FormulaC10H7ClN2O2
Molecular Weight222.63 g/mol
Exact Mass222.02
IUPAC Name3-chloro-N-(1,2-oxazol-3-yl)benzamide
SMILESO=C(Nc1ccon1)c1cccc(Cl)c1
InChIInChI=1S/C10H7ClN2O2/c11-8-3-1-2-7(6-8)10(14)12-9-4-5-15-13-9/h1-6H,(H,12,13,14)
InChIKeyYMDSPAORQHWBQI-UHFFFAOYSA-N
XLogP2.58
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.63
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Dichloro-N-(5-methyl-3-isoxazolyl)benzamide
CID 670270
Benzamide, N-(5-methyl-3-isoxazolyl)-
CID 569560
2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide
CID 6467231
N-(Isoxazol-3-yl)-2-phenylbutanamide
CID 2971247
2-(2-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide
CID 6465012
2-chloro-4,5-difluoro-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 686793
3-(2-chlorophenyl)-N-(5-methyl-3-isoxazolyl)acrylamide
CID 885080
3-(4-chlorophenyl)-N-(5-methyl-3-isoxazolyl)acrylamide
CID 898744
2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 974105
2-(2-chloro-6-fluorophenyl)-N-(1,2-oxazol-3-yl)acetamide
CID 1246693
2-chloro-6-fluoro-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 4122373
2-chloro-N-(1,2-oxazol-3-yl)benzamide
CID 896784

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(1,2-oxazol-3-yl)benzamide?
The IUPAC name of 3-chloro-N-(1,2-oxazol-3-yl)benzamide (CID 1247464) is 3-chloro-N-(1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 3-chloro-N-(1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 3-chloro-N-(1,2-oxazol-3-yl)benzamide is O=C(Nc1ccon1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(1,2-oxazol-3-yl)benzamide?
The InChIKey is YMDSPAORQHWBQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN2O2/c11-8-3-1-2-7(6-8)10(14)12-9-4-5-15-13-9/h1-6H,(H,12,13,14).
What are the key properties of 3-chloro-N-(1,2-oxazol-3-yl)benzamide?
3-chloro-N-(1,2-oxazol-3-yl)benzamide has a molecular weight of 222.63 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 1247464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).