N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide

C19H13N3O2 — CID 1485419

IUPACN-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(-c2cnc3ccccc3n2)c1)c1ccco1
InChIInChI=1S/C19H13N3O2/c23-19(18-9-4-10-24-18)21-14-6-3-5-13(11-14)17-12-20-15-7-1-2-8-16(15)22-17/h1-12H,(H,21,23)
InChIKeyZGBOTUFBKWFGBF-UHFFFAOYSA-N
MW315.33 g/mol
LogP4.14
Rot. Bonds3

About N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide

N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide (PubChem CID 1485419) has the molecular formula C19H13N3O2 and a molecular weight of 315.33 g/mol. Its IUPAC name is N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide
PubChem CID1485419
Molecular FormulaC19H13N3O2
Molecular Weight315.33 g/mol
Exact Mass315.10
IUPAC NameN-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(-c2cnc3ccccc3n2)c1)c1ccco1
InChIInChI=1S/C19H13N3O2/c23-19(18-9-4-10-24-18)21-14-6-3-5-13(11-14)17-12-20-15-7-1-2-8-16(15)22-17/h1-12H,(H,21,23)
InChIKeyZGBOTUFBKWFGBF-UHFFFAOYSA-N
XLogP4.14
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide?
The IUPAC name of N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide (CID 1485419) is N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide.
What is the SMILES notation for N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide?
The canonical SMILES for N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide is O=C(Nc1cccc(-c2cnc3ccccc3n2)c1)c1ccco1.
What is the InChIKey of N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide?
The InChIKey is ZGBOTUFBKWFGBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O2/c23-19(18-9-4-10-24-18)21-14-6-3-5-13(11-14)17-12-20-15-7-1-2-8-16(15)22-17/h1-12H,(H,21,23).
What are the key properties of N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide?
N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide has a molecular weight of 315.33 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-quinoxalin-2-ylphenyl)furan-2-carboxamide is sourced from PubChem (CID 1485419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).