3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide

C11H9BrN2O2 — CID 115669415

IUPAC3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide
SMILESCc1coc(NC(=O)c2cccc(Br)c2)n1
InChIInChI=1S/C11H9BrN2O2/c1-7-6-16-11(13-7)14-10(15)8-3-2-4-9(12)5-8/h2-6H,1H3,(H,13,14,15)
InChIKeyFPWRQVZMLLOURZ-UHFFFAOYSA-N
MW281.11 g/mol
LogP3.00
Rot. Bonds2

About 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide

3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide (PubChem CID 115669415) has the molecular formula C11H9BrN2O2 and a molecular weight of 281.11 g/mol. Its IUPAC name is 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide.

Molecular Properties

Compound Name3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide
PubChem CID115669415
Molecular FormulaC11H9BrN2O2
Molecular Weight281.11 g/mol
Exact Mass279.98
IUPAC Name3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide
SMILESCc1coc(NC(=O)c2cccc(Br)c2)n1
InChIInChI=1S/C11H9BrN2O2/c1-7-6-16-11(13-7)14-10(15)8-3-2-4-9(12)5-8/h2-6H,1H3,(H,13,14,15)
InChIKeyFPWRQVZMLLOURZ-UHFFFAOYSA-N
XLogP3.00
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.11
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(4-methyl-1,3-oxazol-2-yl)pyridine-3-carboxamide
CID 115669424
5-bromo-2-fluoro-N-(4-methyl-1,3-oxazol-2-yl)benzamide
CID 115669438
2-benzamido-N-(3-bromophenyl)-1,3-oxazole-4-carboxamide
CID 90514961
3-bromo-N-(4-chloro-6-methylpyrimidin-2-yl)benzamide
CID 114052917
3-bromo-N-(4-methyl-1,2,5-oxadiazol-3-yl)benzamide
CID 23992514
3-bromo-N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]benzamide
CID 108765874
3-bromo-N-(4-methoxy-6-methylpyrimidin-2-yl)benzamide
CID 103916876
3-bromo-N-(3-bromo-5-methylphenyl)benzamide
CID 107583869
3-amino-5-iodo-N-(4-methyl-1,3-oxazol-2-yl)benzamide
CID 112750930
3-bromo-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]benzamide
CID 56699999
3-bromo-N-(7-methyl-[1,3]thiazolo[5,4-g][1,3]benzoxazol-2-yl)benzamide
CID 118507162
3-bromo-N-[4-[(4-methylbenzoyl)amino]phenyl]benzamide
CID 2844876

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
The IUPAC name of 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide (CID 115669415) is 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide.
What is the SMILES notation for 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
The canonical SMILES for 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide is Cc1coc(NC(=O)c2cccc(Br)c2)n1.
What is the InChIKey of 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
The InChIKey is FPWRQVZMLLOURZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN2O2/c1-7-6-16-11(13-7)14-10(15)8-3-2-4-9(12)5-8/h2-6H,1H3,(H,13,14,15).
What are the key properties of 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide has a molecular weight of 281.11 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(4-methyl-1,3-oxazol-2-yl)benzamide is sourced from PubChem (CID 115669415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).