2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide

C10H8ClN3O2 — CID 62902220

IUPAC2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide
SMILESNc1cc(Cl)ccc1C(=O)Nc1cnoc1
InChIInChI=1S/C10H8ClN3O2/c11-6-1-2-8(9(12)3-6)10(15)14-7-4-13-16-5-7/h1-5H,12H2,(H,14,15)
InChIKeyATXFEKIWNAUQBY-UHFFFAOYSA-N
MW237.65 g/mol
LogP2.16
Rot. Bonds2

About 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide

2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide (PubChem CID 62902220) has the molecular formula C10H8ClN3O2 and a molecular weight of 237.65 g/mol. Its IUPAC name is 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide.

Molecular Properties

Compound Name2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide
PubChem CID62902220
Molecular FormulaC10H8ClN3O2
Molecular Weight237.65 g/mol
Exact Mass237.03
IUPAC Name2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide
SMILESNc1cc(Cl)ccc1C(=O)Nc1cnoc1
InChIInChI=1S/C10H8ClN3O2/c11-6-1-2-8(9(12)3-6)10(15)14-7-4-13-16-5-7/h1-5H,12H2,(H,14,15)
InChIKeyATXFEKIWNAUQBY-UHFFFAOYSA-N
XLogP2.16
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.65
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-fluoro-N-(1,2-oxazol-4-yl)benzamide
CID 62902582
2-amino-4-chloro-N-(6-fluoro-3-pyridinyl)benzamide
CID 114052632
2-amino-4-chloro-N-(3,5-difluorophenyl)benzamide
CID 16783519
2-amino-4-chloro-N-(3,5-dichloro-4-fluorophenyl)benzamide
CID 107571179
2-fluoro-5-methyl-N-(1,2-oxazol-4-yl)benzamide
CID 62904514
4-bromo-2-fluoro-N-(1,2-oxazol-4-yl)benzamide
CID 55210684
3-amino-2-methyl-N-(1,2-oxazol-4-yl)benzamide
CID 62902054
2-amino-N-[3-(carbamoylamino)phenyl]-4-chlorobenzamide
CID 62058536
4-[(2-amino-4-chlorobenzoyl)amino]-2-chlorobenzamide
CID 62057564
2-amino-4-chloro-N-quinolin-3-ylbenzamide
CID 61111494
5-amino-N-(1,2-oxazol-4-yl)-1,2-oxazole-3-carboxamide
CID 130563046
2-amino-4-chloro-N-(4-ethylphenyl)benzamide
CID 28605488

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide?
The IUPAC name of 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide (CID 62902220) is 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide.
What is the SMILES notation for 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide?
The canonical SMILES for 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide is Nc1cc(Cl)ccc1C(=O)Nc1cnoc1.
What is the InChIKey of 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide?
The InChIKey is ATXFEKIWNAUQBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3O2/c11-6-1-2-8(9(12)3-6)10(15)14-7-4-13-16-5-7/h1-5H,12H2,(H,14,15).
What are the key properties of 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide?
2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide has a molecular weight of 237.65 g/mol, XLogP of 2.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-chloro-N-(1,2-oxazol-4-yl)benzamide is sourced from PubChem (CID 62902220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).