N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide

C22H19N3O2 — CID 121334604

IUPACN-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide
SMILESCN(C(=O)c1ccc(-c2cn(C)c(=O)c3[nH]ccc23)cc1)c1ccccc1
InChIInChI=1S/C22H19N3O2/c1-24-14-19(18-12-13-23-20(18)22(24)27)15-8-10-16(11-9-15)21(26)25(2)17-6-4-3-5-7-17/h3-14,23H,1-2H3
InChIKeyMLHSKFFUZSUUEV-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.81
Rot. Bonds3

About N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide

N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide (PubChem CID 121334604) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide.

Molecular Properties

Compound NameN-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide
PubChem CID121334604
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC NameN-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide
SMILESCN(C(=O)c1ccc(-c2cn(C)c(=O)c3[nH]ccc23)cc1)c1ccccc1
InChIInChI=1S/C22H19N3O2/c1-24-14-19(18-12-13-23-20(18)22(24)27)15-8-10-16(11-9-15)21(26)25(2)17-6-4-3-5-7-17/h3-14,23H,1-2H3
InChIKeyMLHSKFFUZSUUEV-UHFFFAOYSA-N
XLogP3.81
TPSA58.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-aminophenyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one
CID 121334596
6-methyl-4-[4-(4-methylpiperidine-1-carbonyl)phenyl]-1H-pyrrolo[2,3-c]pyridin-7-one
CID 121334620
N-[(2-ethoxyphenyl)methyl]-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)benzamide
CID 171637956
6-methyl-4-[4-(morpholine-4-carbonyl)phenyl]-1H-pyrrolo[2,3-c]pyridin-7-one;molecular hydrogen
CID 145081735
N-methyl-N-[3-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-4-phenoxyphenyl]propanamide
CID 171083432
6-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-1H-pyrrolo[2,3-c]pyridin-7-one
CID 121334626
4-amino-N-methyl-N-phenylbenzamide
CID 4306081
N-methyl-4-[(E)-2-[4-[methyl(phenyl)carbamoyl]phenyl]ethenyl]-N-phenylbenzamide
CID 134109031
4-(3-hydroxy-2-phenoxyphenyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(3-methoxy-2-phenoxyphenyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one
CID 164966773
4-methyl-7-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
CID 121334630
4-[5-(2-hydroxyphenoxy)-1-methyl-2-oxo-4-pyridinyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one
CID 155234596
4-(4-fluorophenyl)-2-methylisoquinolin-1-one
CID 134913964

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide?
The IUPAC name of N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide (CID 121334604) is N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide.
What is the SMILES notation for N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide?
The canonical SMILES for N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide is CN(C(=O)c1ccc(-c2cn(C)c(=O)c3[nH]ccc23)cc1)c1ccccc1.
What is the InChIKey of N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide?
The InChIKey is MLHSKFFUZSUUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-24-14-19(18-12-13-23-20(18)22(24)27)15-8-10-16(11-9-15)21(26)25(2)17-6-4-3-5-7-17/h3-14,23H,1-2H3.
What are the key properties of N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide?
N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide has a molecular weight of 357.41 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N-phenylbenzamide is sourced from PubChem (CID 121334604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).