N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide

C18H12N2O3 — CID 713013

IUPACN-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide
SMILESO=C(Nc1ccc2oc(-c3ccccc3)nc2c1)c1ccco1
InChIInChI=1S/C18H12N2O3/c21-17(16-7-4-10-22-16)19-13-8-9-15-14(11-13)20-18(23-15)12-5-2-1-3-6-12/h1-11H,(H,19,21)
InChIKeyYVAABBIEUQFOLE-UHFFFAOYSA-N
MW304.31 g/mol
LogP4.34
Rot. Bonds3

About N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide

N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide (PubChem CID 713013) has the molecular formula C18H12N2O3 and a molecular weight of 304.31 g/mol. Its IUPAC name is N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide
PubChem CID713013
Molecular FormulaC18H12N2O3
Molecular Weight304.31 g/mol
Exact Mass304.08
IUPAC NameN-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide
SMILESO=C(Nc1ccc2oc(-c3ccccc3)nc2c1)c1ccco1
InChIInChI=1S/C18H12N2O3/c21-17(16-7-4-10-22-16)19-13-8-9-15-14(11-13)20-18(23-15)12-5-2-1-3-6-12/h1-11H,(H,19,21)
InChIKeyYVAABBIEUQFOLE-UHFFFAOYSA-N
XLogP4.34
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-phenyl-1,3-benzoxazol-5-yl)furan-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

Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
The IUPAC name of N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide (CID 713013) is N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide.
What is the SMILES notation for N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
The canonical SMILES for N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide is O=C(Nc1ccc2oc(-c3ccccc3)nc2c1)c1ccco1.
What is the InChIKey of N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
The InChIKey is YVAABBIEUQFOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2O3/c21-17(16-7-4-10-22-16)19-13-8-9-15-14(11-13)20-18(23-15)12-5-2-1-3-6-12/h1-11H,(H,19,21).
What are the key properties of N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide?
N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide has a molecular weight of 304.31 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-1,3-benzoxazol-5-yl)furan-2-carboxamide is sourced from PubChem (CID 713013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).