2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide

C23H23N3O — CID 109169666

IUPAC2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
SMILESCc1ccccc1CNC(=O)c1ccnc(N2c3ccccc3CC2C)c1
InChIInChI=1S/C23H23N3O/c1-16-7-3-4-9-20(16)15-25-23(27)19-11-12-24-22(14-19)26-17(2)13-18-8-5-6-10-21(18)26/h3-12,14,17H,13,15H2,1-2H3,(H,25,27)
InChIKeyIUKIZCWXLDJEFS-UHFFFAOYSA-N
MW357.46 g/mol
LogP4.40
Rot. Bonds4

About 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide

2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide (PubChem CID 109169666) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
PubChem CID109169666
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
SMILESCc1ccccc1CNC(=O)c1ccnc(N2c3ccccc3CC2C)c1
InChIInChI=1S/C23H23N3O/c1-16-7-3-4-9-20(16)15-25-23(27)19-11-12-24-22(14-19)26-17(2)13-18-8-5-6-10-21(18)26/h3-12,14,17H,13,15H2,1-2H3,(H,25,27)
InChIKeyIUKIZCWXLDJEFS-UHFFFAOYSA-N
XLogP4.40
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide
CID 109210024
5-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280070
N-[2-(4-fluorophenyl)ethyl]-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-4-carboxamide
CID 109172647
6-methyl-2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109327550
4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrimidin-2-amine
CID 112889950
N-benzyl-N-methyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-4-carboxamide
CID 109170283
methyl 4-[[2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-4-carbonyl]amino]benzoate
CID 109178653
N-(2,4-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-4-carboxamide
CID 109178358
N-(2,5-dimethoxyphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-4-carboxamide
CID 109178330
N-[(4-fluorophenyl)methyl]-6-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109156755
N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109209427
N-[(2-methylphenyl)methyl]-2-(piperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081205

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide (CID 109169666) is 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide is Cc1ccccc1CNC(=O)c1ccnc(N2c3ccccc3CC2C)c1.
What is the InChIKey of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
The InChIKey is IUKIZCWXLDJEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O/c1-16-7-3-4-9-20(16)15-25-23(27)19-11-12-24-22(14-19)26-17(2)13-18-8-5-6-10-21(18)26/h3-12,14,17H,13,15H2,1-2H3,(H,25,27).
What are the key properties of 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide?
2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide has a molecular weight of 357.46 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 109169666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).