N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide

C18H17N5O2 — CID 86602651

IUPACN-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide
SMILESCc1cc2nc(-c3[nH]ncc3NC(=O)c3ccoc3)n(C)c2cc1C
InChIInChI=1S/C18H17N5O2/c1-10-6-13-15(7-11(10)2)23(3)17(20-13)16-14(8-19-22-16)21-18(24)12-4-5-25-9-12/h4-9H,1-3H3,(H,19,22)(H,21,24)
InChIKeyHTGVZPYLVXEQJN-UHFFFAOYSA-N
MW335.37 g/mol
LogP3.43
Rot. Bonds3

About N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide

N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide (PubChem CID 86602651) has the molecular formula C18H17N5O2 and a molecular weight of 335.37 g/mol. Its IUPAC name is N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide
PubChem CID86602651
Molecular FormulaC18H17N5O2
Molecular Weight335.37 g/mol
Exact Mass335.14
IUPAC NameN-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide
SMILESCc1cc2nc(-c3[nH]ncc3NC(=O)c3ccoc3)n(C)c2cc1C
InChIInChI=1S/C18H17N5O2/c1-10-6-13-15(7-11(10)2)23(3)17(20-13)16-14(8-19-22-16)21-18(24)12-4-5-25-9-12/h4-9H,1-3H3,(H,19,22)(H,21,24)
InChIKeyHTGVZPYLVXEQJN-UHFFFAOYSA-N
XLogP3.43
TPSA88.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.37
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-methylbenzamide
CID 135804549
N-[5-(N'-hydroxycarbamimidoyl)-2-methylphenyl]furan-3-carboxamide
CID 76935512
N-(5-tert-butyl-1H-pyrazol-3-yl)furan-3-carboxamide
CID 47343702
N-[2-[(5-chloro-1-methylbenzimidazol-2-yl)amino]-2-oxoethyl]furan-3-carboxamide
CID 51099324
N-(2-methoxyphenyl)furan-3-carboxamide
CID 17437625
5-methyl-N-(4-methyl-1H-pyrazol-5-yl)furan-3-carboxamide
CID 114821900
N-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]cyclopenta-1,4-diene-1-carboxamide
CID 136608966
N-[2-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]furan-3-carboxamide
CID 59754517
N-[2,4-bis(dimethylamino)pyrimidin-5-yl]furan-3-carboxamide
CID 122319704
N-[4-methyl-3-(2-methylpropanoylamino)phenyl]furan-3-carboxamide
CID 131948367
N-(2-methoxy-5-sulfamoylphenyl)furan-3-carboxamide
CID 47129641
N-(2-bromo-4-fluorophenyl)furan-3-carboxamide
CID 28938638

Frequently Asked Questions

What is the IUPAC name of N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide?
The IUPAC name of N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide (CID 86602651) is N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide.
What is the SMILES notation for N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide?
The canonical SMILES for N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide is Cc1cc2nc(-c3[nH]ncc3NC(=O)c3ccoc3)n(C)c2cc1C.
What is the InChIKey of N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide?
The InChIKey is HTGVZPYLVXEQJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O2/c1-10-6-13-15(7-11(10)2)23(3)17(20-13)16-14(8-19-22-16)21-18(24)12-4-5-25-9-12/h4-9H,1-3H3,(H,19,22)(H,21,24).
What are the key properties of N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide?
N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide has a molecular weight of 335.37 g/mol, XLogP of 3.43, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1,5,6-trimethylbenzimidazol-2-yl)-1H-pyrazol-4-yl]furan-3-carboxamide is sourced from PubChem (CID 86602651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).