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

C15H11ClN2O2 — CID 156906371

IUPACN-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1noc2ccccc12
InChIInChI=1S/C15H11ClN2O2/c16-11-5-3-4-10(8-11)9-14(19)17-15-12-6-1-2-7-13(12)20-18-15/h1-8H,9H2,(H,17,18,19)
InChIKeyOFZNLVQMGMHSHM-UHFFFAOYSA-N
MW286.72 g/mol
LogP3.66
Rot. Bonds3

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

N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide (PubChem CID 156906371) has the molecular formula C15H11ClN2O2 and a molecular weight of 286.72 g/mol. Its IUPAC name is N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide
PubChem CID156906371
Molecular FormulaC15H11ClN2O2
Molecular Weight286.72 g/mol
Exact Mass286.05
IUPAC NameN-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1noc2ccccc12
InChIInChI=1S/C15H11ClN2O2/c16-11-5-3-4-10(8-11)9-14(19)17-15-12-6-1-2-7-13(12)20-18-15/h1-8H,9H2,(H,17,18,19)
InChIKeyOFZNLVQMGMHSHM-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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Frequently Asked Questions

What is the IUPAC name of N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide?
The IUPAC name of N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide (CID 156906371) is N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide.
What is the SMILES notation for N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide?
The canonical SMILES for N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide is O=C(Cc1cccc(Cl)c1)Nc1noc2ccccc12.
What is the InChIKey of N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide?
The InChIKey is OFZNLVQMGMHSHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O2/c16-11-5-3-4-10(8-11)9-14(19)17-15-12-6-1-2-7-13(12)20-18-15/h1-8H,9H2,(H,17,18,19).
What are the key properties of N-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide?
N-(1,2-benzoxazol-3-yl)-2-(3-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-(1,2-benzoxazol-3-yl)-2-(3-chlorophenyl)acetamide is sourced from PubChem (CID 156906371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).