N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide

C22H19N3O2 — CID 109242503

IUPACN-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cncc(N3CCc4ccccc43)c2)c1
InChIInChI=1S/C22H19N3O2/c1-15(26)17-6-4-7-19(11-17)24-22(27)18-12-20(14-23-13-18)25-10-9-16-5-2-3-8-21(16)25/h2-8,11-14H,9-10H2,1H3,(H,24,27)
InChIKeyJLQQMGYJJIUGGN-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.23
Rot. Bonds4

About N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide

N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide (PubChem CID 109242503) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
PubChem CID109242503
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC NameN-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cncc(N3CCc4ccccc43)c2)c1
InChIInChI=1S/C22H19N3O2/c1-15(26)17-6-4-7-19(11-17)24-22(27)18-12-20(14-23-13-18)25-10-9-16-5-2-3-8-21(16)25/h2-8,11-14H,9-10H2,1H3,(H,24,27)
InChIKeyJLQQMGYJJIUGGN-UHFFFAOYSA-N
XLogP4.23
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamidophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109242505
N-(4-chlorophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109242479
5-(2,3-dihydroindol-1-yl)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109242491
5-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109242624
N-(2,5-dichlorophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109242525
N-(3-acetylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228678
5-(2,3-dihydroindol-1-yl)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 109235536
N-(3-acetylphenyl)-2-(2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109314422
N-(2,6-difluorophenyl)-5-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
CID 109242657
N-(5-chloro-2-methoxyphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109242487
N-(3-acetamidophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109197843
N-(4-chloro-2-methoxy-5-methylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109242529

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide (CID 109242503) is N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide is CC(=O)c1cccc(NC(=O)c2cncc(N3CCc4ccccc43)c2)c1.
What is the InChIKey of N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The InChIKey is JLQQMGYJJIUGGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-15(26)17-6-4-7-19(11-17)24-22(27)18-12-20(14-23-13-18)25-10-9-16-5-2-3-8-21(16)25/h2-8,11-14H,9-10H2,1H3,(H,24,27).
What are the key properties of N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109242503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).