N-(3-methylcinnolin-5-yl)-2-phenylbenzamide

C22H17N3O — CID 59643758

IUPACN-(3-methylcinnolin-5-yl)-2-phenylbenzamide
SMILESCc1cc2c(NC(=O)c3ccccc3-c3ccccc3)cccc2nn1
InChIInChI=1S/C22H17N3O/c1-15-14-19-20(12-7-13-21(19)25-24-15)23-22(26)18-11-6-5-10-17(18)16-8-3-2-4-9-16/h2-14H,1H3,(H,23,26)
InChIKeyLRVTWFUOROLNNE-UHFFFAOYSA-N
MW339.40 g/mol
LogP4.86
Rot. Bonds3

About N-(3-methylcinnolin-5-yl)-2-phenylbenzamide

N-(3-methylcinnolin-5-yl)-2-phenylbenzamide (PubChem CID 59643758) has the molecular formula C22H17N3O and a molecular weight of 339.40 g/mol. Its IUPAC name is N-(3-methylcinnolin-5-yl)-2-phenylbenzamide.

Molecular Properties

Compound NameN-(3-methylcinnolin-5-yl)-2-phenylbenzamide
PubChem CID59643758
Molecular FormulaC22H17N3O
Molecular Weight339.40 g/mol
Exact Mass339.14
IUPAC NameN-(3-methylcinnolin-5-yl)-2-phenylbenzamide
SMILESCc1cc2c(NC(=O)c3ccccc3-c3ccccc3)cccc2nn1
InChIInChI=1S/C22H17N3O/c1-15-14-19-20(12-7-13-21(19)25-24-15)23-22(26)18-11-6-5-10-17(18)16-8-3-2-4-9-16/h2-14H,1H3,(H,23,26)
InChIKeyLRVTWFUOROLNNE-UHFFFAOYSA-N
XLogP4.86
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylcinnolin-5-yl)-2,1,3-benzothiadiazole-4-carboxamide
CID 42545433
2-phenyl-N-(2-phenylphenyl)benzamide
CID 2216278
methyl 2-amino-3-[(2-phenylbenzoyl)amino]benzoate
CID 141290737
N-(5-chloro-2-methylphenyl)-2-phenylbenzamide
CID 976295
N-(2-carbamoylphenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 2886854
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
N-(2-phenylphenyl)quinoline-4-carboxamide
CID 142724043
methyl 2-[(3,6-dimethylpyridazine-4-carbonyl)amino]benzoate
CID 115872529
N-(2,3-dimethylphenyl)-2-(4-phenylphenyl)quinoline-4-carboxamide
CID 5129728
2-methyl-N-(2-methylquinolin-4-yl)benzamide
CID 3291896
2-methyl-6-phenyl-N-quinolin-5-ylpyridine-3-carboxamide
CID 34130475
N-(2-methyl-1,3-dioxoisoindol-4-yl)-2-phenylquinoline-4-carboxamide
CID 7157915

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcinnolin-5-yl)-2-phenylbenzamide?
The IUPAC name of N-(3-methylcinnolin-5-yl)-2-phenylbenzamide (CID 59643758) is N-(3-methylcinnolin-5-yl)-2-phenylbenzamide.
What is the SMILES notation for N-(3-methylcinnolin-5-yl)-2-phenylbenzamide?
The canonical SMILES for N-(3-methylcinnolin-5-yl)-2-phenylbenzamide is Cc1cc2c(NC(=O)c3ccccc3-c3ccccc3)cccc2nn1.
What is the InChIKey of N-(3-methylcinnolin-5-yl)-2-phenylbenzamide?
The InChIKey is LRVTWFUOROLNNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O/c1-15-14-19-20(12-7-13-21(19)25-24-15)23-22(26)18-11-6-5-10-17(18)16-8-3-2-4-9-16/h2-14H,1H3,(H,23,26).
What are the key properties of N-(3-methylcinnolin-5-yl)-2-phenylbenzamide?
N-(3-methylcinnolin-5-yl)-2-phenylbenzamide has a molecular weight of 339.40 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcinnolin-5-yl)-2-phenylbenzamide is sourced from PubChem (CID 59643758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).