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

C16H14N2O3 — CID 110774161

IUPAC2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide
SMILESCn1c(=O)oc2ccc(CC(=O)Nc3ccccc3)cc21
InChIInChI=1S/C16H14N2O3/c1-18-13-9-11(7-8-14(13)21-16(18)20)10-15(19)17-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,19)
InChIKeyJTAPENXZZSVBLC-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.31
Rot. Bonds3

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

2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide (PubChem CID 110774161) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide
PubChem CID110774161
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide
SMILESCn1c(=O)oc2ccc(CC(=O)Nc3ccccc3)cc21
InChIInChI=1S/C16H14N2O3/c1-18-13-9-11(7-8-14(13)21-16(18)20)10-15(19)17-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,19)
InChIKeyJTAPENXZZSVBLC-UHFFFAOYSA-N
XLogP2.31
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[[2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)acetyl]amino]benzoate
CID 110774208
1-[2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)ethyl]-3-phenylurea
CID 110776299
N-(2-methoxyphenyl)-2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)acetamide
CID 110774189
2-(3-methoxyphenyl)-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)acetamide
CID 110662027
2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-(2-methylpropyl)acetamide
CID 110774091
N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]-2-(2-methylphenyl)acetamide
CID 110786905
N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]-3-phenylpropanamide
CID 110786871
3-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)propanoic acid
CID 82494222
2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 110774127
3-(2-fluorophenyl)-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)propanamide
CID 110607968
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-2-(4-methylphenyl)acetamide
CID 110662181
1-[2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)ethyl]-3-phenylurea
CID 110776289

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide?
The IUPAC name of 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide (CID 110774161) is 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide.
What is the SMILES notation for 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide?
The canonical SMILES for 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide is Cn1c(=O)oc2ccc(CC(=O)Nc3ccccc3)cc21.
What is the InChIKey of 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide?
The InChIKey is JTAPENXZZSVBLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-18-13-9-11(7-8-14(13)21-16(18)20)10-15(19)17-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,19).
What are the key properties of 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide?
2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide has a molecular weight of 282.30 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)-N-phenylacetamide is sourced from PubChem (CID 110774161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).