N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide

C21H19N5O2 — CID 56503212

IUPACN-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
SMILESCc1c[nH]c(=O)n1-c1ccccc1NC(=O)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C21H19N5O2/c1-15-13-22-21(28)26(15)19-6-3-2-5-18(19)24-20(27)17-9-7-16(8-10-17)14-25-12-4-11-23-25/h2-13H,14H2,1H3,(H,22,28)(H,24,27)
InChIKeyWUPWGUFQDOQBTP-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.97
Rot. Bonds5

About N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide

N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide (PubChem CID 56503212) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
PubChem CID56503212
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC NameN-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
SMILESCc1c[nH]c(=O)n1-c1ccccc1NC(=O)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C21H19N5O2/c1-15-13-22-21(28)26(15)19-6-3-2-5-18(19)24-20(27)17-9-7-16(8-10-17)14-25-12-4-11-23-25/h2-13H,14H2,1H3,(H,22,28)(H,24,27)
InChIKeyWUPWGUFQDOQBTP-UHFFFAOYSA-N
XLogP2.97
TPSA84.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylsulfonylphenyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 55534682
5-chloro-3-methyl-N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide
CID 56502435
N-(2-hydroxy-4-methylphenyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 18138231
4-methoxy-N-[2-[[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]carbamoylamino]ethyl]benzamide
CID 56554813
N-[2-(3-phenyl-1H-1,2,4-triazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 55991421
N-(2,4-dimethoxyphenyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 18141970
N-(4-chloro-2,5-dimethoxyphenyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 26022355
4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
CID 167793596
1-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-3-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]urea
CID 56553525
2-(4-methoxyphenyl)-N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 56503203
N-[4-(diethylamino)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 134036419
4-(pyrazol-1-ylmethyl)-N-thiophen-3-ylbenzamide
CID 175249041

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The IUPAC name of N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide (CID 56503212) is N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide.
What is the SMILES notation for N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The canonical SMILES for N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide is Cc1c[nH]c(=O)n1-c1ccccc1NC(=O)c1ccc(Cn2cccn2)cc1.
What is the InChIKey of N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The InChIKey is WUPWGUFQDOQBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c1-15-13-22-21(28)26(15)19-6-3-2-5-18(19)24-20(27)17-9-7-16(8-10-17)14-25-12-4-11-23-25/h2-13H,14H2,1H3,(H,22,28)(H,24,27).
What are the key properties of N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide has a molecular weight of 373.42 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methyl-2-oxo-1H-imidazol-3-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide is sourced from PubChem (CID 56503212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).