5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide

C21H19N3O — CID 109241516

IUPAC5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1c1cncc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C21H19N3O/c1-15-11-16-7-5-6-10-20(16)24(15)19-12-17(13-22-14-19)21(25)23-18-8-3-2-4-9-18/h2-10,12-15H,11H2,1H3,(H,23,25)
InChIKeyGCKYSXKWBWYNOZ-UHFFFAOYSA-N
MW329.40 g/mol
LogP4.42
Rot. Bonds3

About 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide

5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide (PubChem CID 109241516) has the molecular formula C21H19N3O and a molecular weight of 329.40 g/mol. Its IUPAC name is 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide
PubChem CID109241516
Molecular FormulaC21H19N3O
Molecular Weight329.40 g/mol
Exact Mass329.15
IUPAC Name5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1c1cncc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C21H19N3O/c1-15-11-16-7-5-6-10-20(16)24(15)19-12-17(13-22-14-19)21(25)23-18-8-3-2-4-9-18/h2-10,12-15H,11H2,1H3,(H,23,25)
InChIKeyGCKYSXKWBWYNOZ-UHFFFAOYSA-N
XLogP4.42
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109244279
N-(3,4-dimethoxyphenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109245677
5-(2-methyl-2,3-dihydroindol-1-yl)-N-(2-methylpropyl)pyridine-3-carboxamide
CID 109224902
1-[4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]-3-phenylurea
CID 112989569
N-(4-acetylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxamide
CID 109270109
N-(3,4-difluorophenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxamide
CID 109270592
N-[4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]thiophene-2-carboxamide
CID 112989553
N-(3-acetamidophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109242505
N-ethyl-5-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109246296
N-(4-acetylphenyl)-6-methyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109337849
N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109200837
N-[4-(dimethylamino)phenyl]-6-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109164685

Frequently Asked Questions

What is the IUPAC name of 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide?
The IUPAC name of 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide (CID 109241516) is 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide is CC1Cc2ccccc2N1c1cncc(C(=O)Nc2ccccc2)c1.
What is the InChIKey of 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide?
The InChIKey is GCKYSXKWBWYNOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O/c1-15-11-16-7-5-6-10-20(16)24(15)19-12-17(13-22-14-19)21(25)23-18-8-3-2-4-9-18/h2-10,12-15H,11H2,1H3,(H,23,25).
What are the key properties of 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide?
5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 4.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109241516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).