3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide

C15H12N2O3 — CID 37091487

IUPAC3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
SMILESCc1cccc(C(=O)Nc2ccc3oc(=O)[nH]c3c2)c1
InChIInChI=1S/C15H12N2O3/c1-9-3-2-4-10(7-9)14(18)16-11-5-6-13-12(8-11)17-15(19)20-13/h2-8H,1H3,(H,16,18)(H,17,19)
InChIKeySDWXPAIFAMMSHJ-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.68
Rot. Bonds2

About 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide

3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide (PubChem CID 37091487) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
PubChem CID37091487
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
SMILESCc1cccc(C(=O)Nc2ccc3oc(=O)[nH]c3c2)c1
InChIInChI=1S/C15H12N2O3/c1-9-3-2-4-10(7-9)14(18)16-11-5-6-13-12(8-11)17-15(19)20-13/h2-8H,1H3,(H,16,18)(H,17,19)
InChIKeySDWXPAIFAMMSHJ-UHFFFAOYSA-N
XLogP2.68
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methylsulfonyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 37095710
4-benzamido-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 38468547
3-methyl-N-[(2-oxo-3H-1,3-benzoxazol-5-yl)methyl]benzamide
CID 110786718
4-tert-butyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 38466226
N-(2-oxo-3H-1,3-benzoxazol-5-yl)-3-(propylsulfonylamino)benzamide
CID 37155913
3-methoxy-4-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 134019844
4-methylsulfanyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 38466944
1-oxido-N-(2-oxo-3H-1,3-benzoxazol-5-yl)pyridin-1-ium-4-carboxamide
CID 38466723
N-(2-oxo-3H-1,3-benzoxazol-5-yl)-3-pyrrolidin-1-ylsulfonylbenzamide
CID 38466362
N-(2-oxo-3H-1,3-benzoxazol-5-yl)-4-pyrrol-1-ylbenzamide
CID 38467191
N-(3-methylphenyl)-2-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
CID 110774011
3-methyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)benzamide
CID 110427940

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide?
The IUPAC name of 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide (CID 37091487) is 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide.
What is the SMILES notation for 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide?
The canonical SMILES for 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide is Cc1cccc(C(=O)Nc2ccc3oc(=O)[nH]c3c2)c1.
What is the InChIKey of 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide?
The InChIKey is SDWXPAIFAMMSHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-9-3-2-4-10(7-9)14(18)16-11-5-6-13-12(8-11)17-15(19)20-13/h2-8H,1H3,(H,16,18)(H,17,19).
What are the key properties of 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide?
3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide has a molecular weight of 268.27 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide is sourced from PubChem (CID 37091487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).