N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide

C15H11ClN2O2 — CID 90655333

IUPACN-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1nc2ccccc2o1
InChIInChI=1S/C15H11ClN2O2/c16-11-7-5-10(6-8-11)9-14(19)18-15-17-12-3-1-2-4-13(12)20-15/h1-8H,9H2,(H,17,18,19)
InChIKeyWTYHHLUYXYYOKH-UHFFFAOYSA-N
MW286.72 g/mol
LogP3.66
Rot. Bonds3

About N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide

N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide (PubChem CID 90655333) has the molecular formula C15H11ClN2O2 and a molecular weight of 286.72 g/mol. Its IUPAC name is N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide
PubChem CID90655333
Molecular FormulaC15H11ClN2O2
Molecular Weight286.72 g/mol
Exact Mass286.05
IUPAC NameN-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1nc2ccccc2o1
InChIInChI=1S/C15H11ClN2O2/c16-11-7-5-10(6-8-11)9-14(19)18-15-17-12-3-1-2-4-13(12)20-15/h1-8H,9H2,(H,17,18,19)
InChIKeyWTYHHLUYXYYOKH-UHFFFAOYSA-N
XLogP3.66
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.72
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-1,3-benzoxazol-2-yl)-2-(1H-indol-3-yl)acetamide
CID 17402933
2-(1,3-benzoxazol-2-ylsulfanyl)-N-[2-(4-chlorophenyl)ethyl]acetamide
CID 2586084
1-(1,3-benzoxazol-2-yl)-N'-[2-(4-chlorophenyl)acetyl]piperidine-4-carbohydrazide
CID 46698256
N-[2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl]-2-phenylacetamide
CID 3013306
N-(1,3-benzoxazol-2-yl)-5-chlorothiophene-2-carboxamide
CID 112528149
2-(4-chlorophenyl)-N-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]acetamide
CID 1348156
N-(1,3-benzoxazol-2-yl)-4-[[3-(4-chlorophenoxy)phenyl]methyl]piperazine-1-carboxamide
CID 46234314
N-[2-(1,3-benzoxazol-2-yl)ethyl]-2-phenylacetamide
CID 110711803
N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-(2,4-dichlorophenyl)acetamide
CID 18225429
N-[2-(1,3-benzoxazol-2-yl)ethyl]-2-(3-chlorophenyl)acetamide
CID 110711846
2-[4-(1,3-benzoxazol-2-ylamino)-2,5-dichlorophenyl]acetic acid
CID 58984866
N-[2-(4-chlorobenzoyl)-1-benzofuran-3-yl]-2-(4-chlorophenyl)acetamide
CID 19114627

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide (CID 90655333) is N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide is O=C(Cc1ccc(Cl)cc1)Nc1nc2ccccc2o1.
What is the InChIKey of N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide?
The InChIKey is WTYHHLUYXYYOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O2/c16-11-7-5-10(6-8-11)9-14(19)18-15-17-12-3-1-2-4-13(12)20-15/h1-8H,9H2,(H,17,18,19).
What are the key properties of N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide?
N-(1,3-benzoxazol-2-yl)-2-(4-chlorophenyl)acetamide has a molecular weight of 286.72 g/mol, XLogP of 3.66, 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-2-yl)-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 90655333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).