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

C16H14N2O3 — CID 4794633

IUPACN-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide
SMILESCN(C(=O)Cn1c(=O)oc2ccccc21)c1ccccc1
InChIInChI=1S/C16H14N2O3/c1-17(12-7-3-2-4-8-12)15(19)11-18-13-9-5-6-10-14(13)21-16(18)20/h2-10H,11H2,1H3
InChIKeySIENPKVCBIGHDG-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.26
Rot. Bonds3

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

N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide (PubChem CID 4794633) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide.

Molecular Properties

Compound NameN-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide
PubChem CID4794633
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC NameN-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide
SMILESCN(C(=O)Cn1c(=O)oc2ccccc21)c1ccccc1
InChIInChI=1S/C16H14N2O3/c1-17(12-7-3-2-4-8-12)15(19)11-18-13-9-5-6-10-14(13)21-16(18)20/h2-10H,11H2,1H3
InChIKeySIENPKVCBIGHDG-UHFFFAOYSA-N
XLogP2.26
TPSA55.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide?
The IUPAC name of N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide (CID 4794633) is N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide.
What is the SMILES notation for N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide?
The canonical SMILES for N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide is CN(C(=O)Cn1c(=O)oc2ccccc21)c1ccccc1.
What is the InChIKey of N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide?
The InChIKey is SIENPKVCBIGHDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-17(12-7-3-2-4-8-12)15(19)11-18-13-9-5-6-10-14(13)21-16(18)20/h2-10H,11H2,1H3.
What are the key properties of N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide?
N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide has a molecular weight of 282.30 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-oxo-1,3-benzoxazol-3-yl)-N-phenylacetamide is sourced from PubChem (CID 4794633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).