N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide

C14H10N6O — CID 155917887

IUPACN-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide
SMILESN#Cc1[nH]cnc1NC(=O)c1cccc(-n2cccn2)c1
InChIInChI=1S/C14H10N6O/c15-8-12-13(17-9-16-12)19-14(21)10-3-1-4-11(7-10)20-6-2-5-18-20/h1-7,9H,(H,16,17)(H,19,21)
InChIKeyRMZHYHNSTQCDLN-UHFFFAOYSA-N
MW278.28 g/mol
LogP1.72
Rot. Bonds3

About N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide

N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide (PubChem CID 155917887) has the molecular formula C14H10N6O and a molecular weight of 278.28 g/mol. Its IUPAC name is N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide.

Molecular Properties

Compound NameN-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide
PubChem CID155917887
Molecular FormulaC14H10N6O
Molecular Weight278.28 g/mol
Exact Mass278.09
IUPAC NameN-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide
SMILESN#Cc1[nH]cnc1NC(=O)c1cccc(-n2cccn2)c1
InChIInChI=1S/C14H10N6O/c15-8-12-13(17-9-16-12)19-14(21)10-3-1-4-11(7-10)20-6-2-5-18-20/h1-7,9H,(H,16,17)(H,19,21)
InChIKeyRMZHYHNSTQCDLN-UHFFFAOYSA-N
XLogP1.72
TPSA99.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-fluorophenyl)-3-pyrazol-1-ylbenzamide
CID 95968194
N-benzyl-3-pyrazol-1-ylbenzamide
CID 110698131
N-(4-methoxyphenyl)-3-pyrazol-1-ylbenzamide
CID 110698189
N-(3-methoxyphenyl)-3-pyrazol-1-ylbenzamide
CID 110698188
N-(3-pyrazol-1-ylphenyl)-3-(tetrazol-1-yl)benzamide
CID 55700294
N-[(4-chlorophenyl)methyl]-3-pyrazol-1-ylbenzamide
CID 110698140
N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-3-pyrazol-1-ylbenzamide
CID 56743823
(3S)-3-(4-fluorophenyl)-3-[(3-pyrazol-1-ylbenzoyl)amino]propanoic acid
CID 97192648
N-[(6-methylpyrimidin-4-yl)methyl]-3-pyrazol-1-ylbenzamide
CID 122263530
N-[2-(oxolan-2-ylmethoxy)phenyl]-3-pyrazol-1-ylbenzamide
CID 131895389
N-(4-cyano-1-propan-2-ylpyrazol-3-yl)-4-pyrazol-1-ylpyridine-2-carboxamide
CID 71853024
N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]-3-pyrazol-1-ylbenzamide
CID 122297788

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide?
The IUPAC name of N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide (CID 155917887) is N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide.
What is the SMILES notation for N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide?
The canonical SMILES for N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide is N#Cc1[nH]cnc1NC(=O)c1cccc(-n2cccn2)c1.
What is the InChIKey of N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide?
The InChIKey is RMZHYHNSTQCDLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6O/c15-8-12-13(17-9-16-12)19-14(21)10-3-1-4-11(7-10)20-6-2-5-18-20/h1-7,9H,(H,16,17)(H,19,21).
What are the key properties of N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide?
N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide has a molecular weight of 278.28 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-1H-imidazol-4-yl)-3-pyrazol-1-ylbenzamide is sourced from PubChem (CID 155917887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).