N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide

C23H19N3O2 — CID 11717640

IUPACN-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide
SMILESCOc1cccc(-c2cc(NC(=O)c3ccccc3)n(-c3ccccc3)n2)c1
InChIInChI=1S/C23H19N3O2/c1-28-20-14-8-11-18(15-20)21-16-22(24-23(27)17-9-4-2-5-10-17)26(25-21)19-12-6-3-7-13-19/h2-16H,1H3,(H,24,27)
InChIKeyAOYKTDCRRAIYDY-UHFFFAOYSA-N
MW369.42 g/mol
LogP4.80
Rot. Bonds5

About N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide

N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide (PubChem CID 11717640) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide.

Molecular Properties

Compound NameN-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide
PubChem CID11717640
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC NameN-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide
SMILESCOc1cccc(-c2cc(NC(=O)c3ccccc3)n(-c3ccccc3)n2)c1
InChIInChI=1S/C23H19N3O2/c1-28-20-14-8-11-18(15-20)21-16-22(24-23(27)17-9-4-2-5-10-17)26(25-21)19-12-6-3-7-13-19/h2-16H,1H3,(H,24,27)
InChIKeyAOYKTDCRRAIYDY-UHFFFAOYSA-N
XLogP4.80
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(3-methoxyphenyl)pyrimidin-4-yl]acetamide
CID 25138075
N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-methoxybenzamide
CID 5330980
2-{[1-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]amino}benzoic acid
CID 2727739
Fgfr2-IN-1
CID 157049296
5-Amino-1-~{tert}-butyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide
CID 145704691
4-(3-methoxybenzyl)-2-methylpyrazolo[1,5-a]quinazolin-5(4H)-one
CID 1481851
N-[1-(4-fluorobenzyl)-3-methyl-1H-pyrazol-5-yl]-3-methoxybenzamide
CID 1509647
4-methoxy-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 2352142
2,3-dimethoxy-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 2353715
3,5-dimethoxy-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 2359886
4-methoxy-N-(3-phenyl-1H-pyrazol-5-yl)benzamide
CID 819077
N-(1,3-diphenyl-1H-pyrazol-5-yl)-3-methoxybenzamide
CID 11710424

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
The IUPAC name of N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide (CID 11717640) is N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide.
What is the SMILES notation for N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
The canonical SMILES for N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide is COc1cccc(-c2cc(NC(=O)c3ccccc3)n(-c3ccccc3)n2)c1.
What is the InChIKey of N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
The InChIKey is AOYKTDCRRAIYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c1-28-20-14-8-11-18(15-20)21-16-22(24-23(27)17-9-4-2-5-10-17)26(25-21)19-12-6-3-7-13-19/h2-16H,1H3,(H,24,27).
What are the key properties of N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide has a molecular weight of 369.42 g/mol, XLogP of 4.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide is sourced from PubChem (CID 11717640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).