2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide

C16H14N2O3 — CID 111536513

IUPAC2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide
SMILESCc1nc2ccc(NC(=O)C(O)c3ccccc3)cc2o1
InChIInChI=1S/C16H14N2O3/c1-10-17-13-8-7-12(9-14(13)21-10)18-16(20)15(19)11-5-3-2-4-6-11/h2-9,15,19H,1H3,(H,18,20)
InChIKeyXYSWRMQSNBYZET-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.81
Rot. Bonds3

About 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide

2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide (PubChem CID 111536513) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide
PubChem CID111536513
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide
SMILESCc1nc2ccc(NC(=O)C(O)c3ccccc3)cc2o1
InChIInChI=1S/C16H14N2O3/c1-10-17-13-8-7-12(9-14(13)21-10)18-16(20)15(19)11-5-3-2-4-6-11/h2-9,15,19H,1H3,(H,18,20)
InChIKeyXYSWRMQSNBYZET-UHFFFAOYSA-N
XLogP2.81
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-[(2-methyl-1,3-benzoxazol-6-yl)amino]-3-oxopropanoic acid
CID 115179128
(2R)-2-amino-N-(2-methyl-1,3-benzoxazol-6-yl)propanamide;dihydrochloride
CID 119842889
N-(2-methyl-1,3-benzoxazol-6-yl)carbamoyl bromide
CID 115193310
2-methyl-3-(methylamino)-N-(2-methyl-1,3-benzoxazol-6-yl)propanamide;dihydrochloride
CID 119842897
2,2-dimethyl-3-[(2-methyl-1,3-benzoxazol-6-yl)amino]-3-oxopropanoic acid
CID 115163948
2-hydroxy-2-(2-methyl-1,3-benzoxazol-6-yl)acetic acid
CID 131325865
3,3,3-trifluoro-N-(2-methyl-1,3-benzoxazol-6-yl)propanamide
CID 86924240
N-(2-methyl-1,3-benzoxazol-6-yl)-3-phenoxypropanamide
CID 110729007
5-bromo-3-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)furan-2-carboxamide
CID 87000879
5-[(2-methyl-1,3-benzoxazol-6-yl)amino]-5-oxopentanoic acid
CID 115163815
2-methyl-N-(1-phenylethyl)-1,3-benzoxazole-6-carboxamide
CID 110765208
2-[(2-methyl-1,3-benzoxazol-6-yl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120974727

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide?
The IUPAC name of 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide (CID 111536513) is 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide.
What is the SMILES notation for 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide?
The canonical SMILES for 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide is Cc1nc2ccc(NC(=O)C(O)c3ccccc3)cc2o1.
What is the InChIKey of 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide?
The InChIKey is XYSWRMQSNBYZET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-10-17-13-8-7-12(9-14(13)21-10)18-16(20)15(19)11-5-3-2-4-6-11/h2-9,15,19H,1H3,(H,18,20).
What are the key properties of 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide?
2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide has a molecular weight of 282.30 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(2-methyl-1,3-benzoxazol-6-yl)-2-phenylacetamide is sourced from PubChem (CID 111536513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).