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

C15H12N2O2 — CID 110728668

IUPACN-(1,3-benzoxazol-5-yl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc2ocnc2c1
InChIInChI=1S/C15H12N2O2/c18-15(8-11-4-2-1-3-5-11)17-12-6-7-14-13(9-12)16-10-19-14/h1-7,9-10H,8H2,(H,17,18)
InChIKeyHPQFRTOWQBDFMV-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.01
Rot. Bonds3

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

N-(1,3-benzoxazol-5-yl)-2-phenylacetamide (PubChem CID 110728668) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is N-(1,3-benzoxazol-5-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(1,3-benzoxazol-5-yl)-2-phenylacetamide
PubChem CID110728668
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC NameN-(1,3-benzoxazol-5-yl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc2ocnc2c1
InChIInChI=1S/C15H12N2O2/c18-15(8-11-4-2-1-3-5-11)17-12-6-7-14-13(9-12)16-10-19-14/h1-7,9-10H,8H2,(H,17,18)
InChIKeyHPQFRTOWQBDFMV-UHFFFAOYSA-N
XLogP3.01
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,3-benzoxazol-5-yl)-3-benzylurea
CID 110748624
N-(1,3-benzoxazol-5-yl)-2-(3-methyl-4-oxophthalazin-1-yl)acetamide
CID 71552259
N-(1,3-benzoxazol-6-yl)-2-(4-fluorophenyl)acetamide
CID 110728862
2-phenyl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide
CID 3013315
N-(1,3-benzoxazol-5-yl)-2-methylbenzamide
CID 110728649
N-(1,3-benzoxazol-5-yl)-3-benzyl-2-oxo-1H-imidazole-4-carboxamide
CID 112525477
N-(1,3-benzoxazol-5-yl)pyridine-4-carboxamide
CID 110728684
N-(4-phenylmethoxyphenyl)-1,3-benzoxazole-5-carboxamide
CID 110388232
benzyl N-(1,3-benzoxazol-6-yl)carbamate
CID 110728886
N-(4-anilinophenyl)-1,3-benzoxazole-5-carboxamide
CID 108795166
N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-2-phenylacetamide
CID 3013306
2-amino-4-(1,3-benzoxazol-6-ylamino)-4-oxobutanoic acid
CID 115180959

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzoxazol-5-yl)-2-phenylacetamide?
The IUPAC name of N-(1,3-benzoxazol-5-yl)-2-phenylacetamide (CID 110728668) is N-(1,3-benzoxazol-5-yl)-2-phenylacetamide.
What is the SMILES notation for N-(1,3-benzoxazol-5-yl)-2-phenylacetamide?
The canonical SMILES for N-(1,3-benzoxazol-5-yl)-2-phenylacetamide is O=C(Cc1ccccc1)Nc1ccc2ocnc2c1.
What is the InChIKey of N-(1,3-benzoxazol-5-yl)-2-phenylacetamide?
The InChIKey is HPQFRTOWQBDFMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c18-15(8-11-4-2-1-3-5-11)17-12-6-7-14-13(9-12)16-10-19-14/h1-7,9-10H,8H2,(H,17,18).
What are the key properties of N-(1,3-benzoxazol-5-yl)-2-phenylacetamide?
N-(1,3-benzoxazol-5-yl)-2-phenylacetamide has a molecular weight of 252.27 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzoxazol-5-yl)-2-phenylacetamide is sourced from PubChem (CID 110728668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).