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

C23H23N3O — CID 109210024

IUPAC4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide
SMILESCc1ccccc1CNC(=O)c1cc(N2c3ccccc3CC2C)ccn1
InChIInChI=1S/C23H23N3O/c1-16-7-3-4-9-19(16)15-25-23(27)21-14-20(11-12-24-21)26-17(2)13-18-8-5-6-10-22(18)26/h3-12,14,17H,13,15H2,1-2H3,(H,25,27)
InChIKeyXTQADKJZYYOSMW-UHFFFAOYSA-N
MW357.46 g/mol
LogP4.40
Rot. Bonds4

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

4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide (PubChem CID 109210024) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide
PubChem CID109210024
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide
SMILESCc1ccccc1CNC(=O)c1cc(N2c3ccccc3CC2C)ccn1
InChIInChI=1S/C23H23N3O/c1-16-7-3-4-9-19(16)15-25-23(27)21-14-20(11-12-24-21)26-17(2)13-18-8-5-6-10-22(18)26/h3-12,14,17H,13,15H2,1-2H3,(H,25,27)
InChIKeyXTQADKJZYYOSMW-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

2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169666
N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109209427
N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109214008
6-methyl-2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109327550
5-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280070
4-(2-methyl-2,3-dihydroindol-1-yl)-N-prop-2-enylpyridine-2-carboxamide
CID 109202250
4-(4-ethylpiperazin-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide
CID 109208557
4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrimidin-2-amine
CID 112889950
2-N-benzyl-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085391
4-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide
CID 109085832
3,4-dihydro-1H-isoquinolin-2-yl-[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methanone
CID 109213833
N-[[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62286320

Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide?
The IUPAC name of 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide (CID 109210024) is 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide is Cc1ccccc1CNC(=O)c1cc(N2c3ccccc3CC2C)ccn1.
What is the InChIKey of 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide?
The InChIKey is XTQADKJZYYOSMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O/c1-16-7-3-4-9-19(16)15-25-23(27)21-14-20(11-12-24-21)26-17(2)13-18-8-5-6-10-22(18)26/h3-12,14,17H,13,15H2,1-2H3,(H,25,27).
What are the key properties of 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide?
4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-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 4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 109210024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).