N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide

C15H15N3O2 — CID 828710

IUPACN-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide
SMILESCC(C)n1cnc2cc(NC(=O)c3ccco3)ccc21
InChIInChI=1S/C15H15N3O2/c1-10(2)18-9-16-12-8-11(5-6-13(12)18)17-15(19)14-4-3-7-20-14/h3-10H,1-2H3,(H,17,19)
InChIKeyRMVIVKNTTVAUBN-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.46
Rot. Bonds3

About N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide

N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide (PubChem CID 828710) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide
PubChem CID828710
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide
SMILESCC(C)n1cnc2cc(NC(=O)c3ccco3)ccc21
InChIInChI=1S/C15H15N3O2/c1-10(2)18-9-16-12-8-11(5-6-13(12)18)17-15(19)14-4-3-7-20-14/h3-10H,1-2H3,(H,17,19)
InChIKeyRMVIVKNTTVAUBN-UHFFFAOYSA-N
XLogP3.46
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1-ethyl-1H-benzimidazol-2-yl)propyl]furan-2-carboxamide
CID 3164555
N-(furan-2-ylmethyl)-1-phenylbenzimidazol-5-amine
CID 828702
2-Furan-2-yl-1-furan-2-ylmethyl-1H-benzoimidazole
CID 650866
N-(2-phenyl-1H-benzimidazol-5-yl)furan-2-carboxamide
CID 1084669
N-[(1H-1,3-benzodiazol-2-yl)methyl]furan-2-carboxamide
CID 659559
Furan-2-carboxylic acid (1-tert-butyl-1H-benzoimidazol-5-yl)-amide
CID 828711
N-(1,2-dimethyl-1H-benzimidazol-5-yl)-2-furamide
CID 828712
N-(1-prop-2-enylbenzimidazol-2-yl)furan-2-carboxamide
CID 873118
3-(Furan-2-ylmethyl)-1,2,3,4-tetrahydro[1,3,5]triazino[1,2-a]benzimidazole
CID 943730
N-[2-(1-methyl-5-nitrobenzimidazol-2-yl)ethyl]furan-2-carboxamide
CID 2975738
N-[2-(1-propylbenzimidazol-2-yl)ethyl]furan-2-carboxamide
CID 3164519
N-[2-[1-(2-methylprop-2-enyl)benzimidazol-2-yl]ethyl]furan-2-carboxamide
CID 3164520

Frequently Asked Questions

What is the IUPAC name of N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide?
The IUPAC name of N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide (CID 828710) is N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide.
What is the SMILES notation for N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide?
The canonical SMILES for N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide is CC(C)n1cnc2cc(NC(=O)c3ccco3)ccc21.
What is the InChIKey of N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide?
The InChIKey is RMVIVKNTTVAUBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-10(2)18-9-16-12-8-11(5-6-13(12)18)17-15(19)14-4-3-7-20-14/h3-10H,1-2H3,(H,17,19).
What are the key properties of N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide?
N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propan-2-ylbenzimidazol-5-yl)furan-2-carboxamide is sourced from PubChem (CID 828710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).