N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide

C15H11N5O2 — CID 171509852

IUPACN-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide
SMILESO=C(Nc1ccc2nc(-c3ncc[nH]3)[nH]c2c1)c1ccco1
InChIInChI=1S/C15H11N5O2/c21-15(12-2-1-7-22-12)18-9-3-4-10-11(8-9)20-14(19-10)13-16-5-6-17-13/h1-8H,(H,16,17)(H,18,21)(H,19,20)
InChIKeyPNXZIILAPFYIHN-UHFFFAOYSA-N
MW293.29 g/mol
LogP2.80
Rot. Bonds3

About N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide

N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide (PubChem CID 171509852) has the molecular formula C15H11N5O2 and a molecular weight of 293.29 g/mol. Its IUPAC name is N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide
PubChem CID171509852
Molecular FormulaC15H11N5O2
Molecular Weight293.29 g/mol
Exact Mass293.09
IUPAC NameN-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide
SMILESO=C(Nc1ccc2nc(-c3ncc[nH]3)[nH]c2c1)c1ccco1
InChIInChI=1S/C15H11N5O2/c21-15(12-2-1-7-22-12)18-9-3-4-10-11(8-9)20-14(19-10)13-16-5-6-17-13/h1-8H,(H,16,17)(H,18,21)(H,19,20)
InChIKeyPNXZIILAPFYIHN-UHFFFAOYSA-N
XLogP2.80
TPSA99.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.29
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-fluorophenyl)-3H-benzimidazol-5-yl]furan-2-carboxamide
CID 57405664
N-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]furan-2-carboxamide
CID 1300314
N-[2-(morpholin-4-ium-4-ylmethyl)-3H-benzimidazol-5-yl]furan-2-carboxamide
CID 7421194
N-phenazin-2-ylfuran-2-carboxamide
CID 73349396
N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-5-nitrofuran-2-carboxamide
CID 60557174
N-(2,3-dimethylquinoxalin-6-yl)furan-2-carboxamide
CID 3734340
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-4-(pyrazol-1-ylmethyl)benzamide
CID 52692587
N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-6-methylpyridazine-4-carboxamide
CID 99790473
N-(2-pyridin-4-yl-3H-benzimidazol-5-yl)benzamide
CID 53371216
N-[4-[[2-(furan-2-yl)-3H-benzimidazol-5-yl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 55863771
4-fluoro-N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-2-iodobenzamide
CID 55946378

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide?
The IUPAC name of N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide (CID 171509852) is N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide?
The canonical SMILES for N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide is O=C(Nc1ccc2nc(-c3ncc[nH]3)[nH]c2c1)c1ccco1.
What is the InChIKey of N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide?
The InChIKey is PNXZIILAPFYIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5O2/c21-15(12-2-1-7-22-12)18-9-3-4-10-11(8-9)20-14(19-10)13-16-5-6-17-13/h1-8H,(H,16,17)(H,18,21)(H,19,20).
What are the key properties of N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide?
N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide has a molecular weight of 293.29 g/mol, XLogP of 2.80, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-imidazol-2-yl)-3H-benzimidazol-5-yl]furan-2-carboxamide is sourced from PubChem (CID 171509852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).