6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide

C23H23N3O — CID 84570241

IUPAC6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
SMILESCc1cc(C)c(NC(=O)c2ccc(N3CCc4ccccc43)nc2)c(C)c1
InChIInChI=1S/C23H23N3O/c1-15-12-16(2)22(17(3)13-15)25-23(27)19-8-9-21(24-14-19)26-11-10-18-6-4-5-7-20(18)26/h4-9,12-14H,10-11H2,1-3H3,(H,25,27)
InChIKeyFXJPBVHROGVYKB-UHFFFAOYSA-N
MW357.46 g/mol
LogP4.95
Rot. Bonds3

About 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide

6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide (PubChem CID 84570241) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
PubChem CID84570241
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
SMILESCc1cc(C)c(NC(=O)c2ccc(N3CCc4ccccc43)nc2)c(C)c1
InChIInChI=1S/C23H23N3O/c1-15-12-16(2)22(17(3)13-15)25-23(27)19-8-9-21(24-14-19)26-11-10-18-6-4-5-7-20(18)26/h4-9,12-14H,10-11H2,1-3H3,(H,25,27)
InChIKeyFXJPBVHROGVYKB-UHFFFAOYSA-N
XLogP4.95
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide (CID 84570241) is 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide is Cc1cc(C)c(NC(=O)c2ccc(N3CCc4ccccc43)nc2)c(C)c1.
What is the InChIKey of 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
The InChIKey is FXJPBVHROGVYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O/c1-15-12-16(2)22(17(3)13-15)25-23(27)19-8-9-21(24-14-19)26-11-10-18-6-4-5-7-20(18)26/h4-9,12-14H,10-11H2,1-3H3,(H,25,27).
What are the key properties of 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide has a molecular weight of 357.46 g/mol, XLogP of 4.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 84570241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).