5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide

C16H9ClN2O4 — CID 134019812

IUPAC5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc2oc(=O)[nH]c2c1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C16H9ClN2O4/c17-9-1-3-12-8(5-9)6-14(22-12)15(20)18-10-2-4-13-11(7-10)19-16(21)23-13/h1-7H,(H,18,20)(H,19,21)
InChIKeyKYQIQSBLJYNKKD-UHFFFAOYSA-N
MW328.71 g/mol
LogP3.77
Rot. Bonds2

About 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide

5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide (PubChem CID 134019812) has the molecular formula C16H9ClN2O4 and a molecular weight of 328.71 g/mol. Its IUPAC name is 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide
PubChem CID134019812
Molecular FormulaC16H9ClN2O4
Molecular Weight328.71 g/mol
Exact Mass328.03
IUPAC Name5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccc2oc(=O)[nH]c2c1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C16H9ClN2O4/c17-9-1-3-12-8(5-9)6-14(22-12)15(20)18-10-2-4-13-11(7-10)19-16(21)23-13/h1-7H,(H,18,20)(H,19,21)
InChIKeyKYQIQSBLJYNKKD-UHFFFAOYSA-N
XLogP3.77
TPSA88.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.71
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-(3,5-dichlorophenyl)-1-benzofuran-2-carboxamide
CID 19240955
2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
CID 37091055
5-chloro-N-(4-nitrophenyl)-1-benzofuran-2-carboxamide
CID 18876031
5-chloro-N-(4-chloro-2-methylphenyl)-1-benzofuran-2-carboxamide
CID 9138973
N-(4-chlorophenyl)-5-fluoro-1-benzofuran-2-carboxamide
CID 78843309
3-bromo-4-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 110607962
4-benzamido-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 38468547
5-chloro-N-[4-(dimethylsulfamoyl)phenyl]-1-benzofuran-2-carboxamide
CID 9328773
5-chloro-N-(2,6-difluorophenyl)-1-benzofuran-2-carboxamide
CID 51217226
(2R)-2-amino-N-(2-oxo-3H-1,3-benzoxazol-5-yl)propanamide
CID 78972326
4-tert-butyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 38466226
3-amino-N-(2-oxo-3H-1,3-benzoxazol-5-yl)pyrazine-2-carboxamide
CID 38467954

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide (CID 134019812) is 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide is O=C(Nc1ccc2oc(=O)[nH]c2c1)c1cc2cc(Cl)ccc2o1.
What is the InChIKey of 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide?
The InChIKey is KYQIQSBLJYNKKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9ClN2O4/c17-9-1-3-12-8(5-9)6-14(22-12)15(20)18-10-2-4-13-11(7-10)19-16(21)23-13/h1-7H,(H,18,20)(H,19,21).
What are the key properties of 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide?
5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide has a molecular weight of 328.71 g/mol, XLogP of 3.77, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 134019812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).