N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide

C22H15N3O2 — CID 1300314

IUPACN-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(-c2nc3cc4ccccc4cc3[nH]2)c1)c1ccco1
InChIInChI=1S/C22H15N3O2/c26-22(20-9-4-10-27-20)23-17-8-3-7-16(11-17)21-24-18-12-14-5-1-2-6-15(14)13-19(18)25-21/h1-13H,(H,23,26)(H,24,25)
InChIKeyGEZWWOWOGKUIGG-UHFFFAOYSA-N
MW353.38 g/mol
LogP5.23
Rot. Bonds3

About N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide

N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide (PubChem CID 1300314) has the molecular formula C22H15N3O2 and a molecular weight of 353.38 g/mol. Its IUPAC name is N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide
PubChem CID1300314
Molecular FormulaC22H15N3O2
Molecular Weight353.38 g/mol
Exact Mass353.12
IUPAC NameN-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(-c2nc3cc4ccccc4cc3[nH]2)c1)c1ccco1
InChIInChI=1S/C22H15N3O2/c26-22(20-9-4-10-27-20)23-17-8-3-7-16(11-17)21-24-18-12-14-5-1-2-6-15(14)13-19(18)25-21/h1-13H,(H,23,26)(H,24,25)
InChIKeyGEZWWOWOGKUIGG-UHFFFAOYSA-N
XLogP5.23
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.38
LogP ≤ 55.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenyl)-3H-benzimidazol-5-yl]furan-2-carboxamide
CID 57405664
N-[3-(1H-benzimidazol-2-yl)phenyl]-1-benzofuran-2-carboxamide
CID 1108445
N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide
CID 171509852
N-[3-(1H-pyrazol-5-yl)phenyl]furan-2-carboxamide
CID 37044226
N-[3-(3-oxo-10-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)phenyl]furan-2-carboxamide
CID 166379494
N-[3-(1H-benzimidazol-2-yl)phenyl]-3-(furan-2-yl)prop-2-enamide
CID 876025
N-[3-[3-(1H-benzimidazol-2-yl)phenyl]phenyl]-3-methylfuran-2-carboxamide
CID 44530614
N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]furan-2-carboxamide
CID 110732473
N-phenazin-2-ylfuran-2-carboxamide
CID 73349396
N-[3-(1H-benzimidazol-2-yl)phenyl]-2,6-difluorobenzamide
CID 3706187
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-methoxybenzamide
CID 2810335
N-[3-(1-methylimidazol-2-yl)phenyl]furan-2-carboxamide
CID 136578540

Frequently Asked Questions

What is the IUPAC name of N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide (CID 1300314) is N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide is O=C(Nc1cccc(-c2nc3cc4ccccc4cc3[nH]2)c1)c1ccco1.
What is the InChIKey of N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide?
The InChIKey is GEZWWOWOGKUIGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3O2/c26-22(20-9-4-10-27-20)23-17-8-3-7-16(11-17)21-24-18-12-14-5-1-2-6-15(14)13-19(18)25-21/h1-13H,(H,23,26)(H,24,25).
What are the key properties of N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide?
N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 5.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 1300314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).