N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide

C24H23N3O2 — CID 109108564

IUPACN-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cncc(C(=O)N2c3ccccc3CC2C)c1)c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-3-26(21-10-5-4-6-11-21)23(28)19-14-20(16-25-15-19)24(29)27-17(2)13-18-9-7-8-12-22(18)27/h4-12,14-17H,3,13H2,1-2H3
InChIKeyPLAVTAYJVOJPGH-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.34
Rot. Bonds4

About N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide

N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide (PubChem CID 109108564) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide
PubChem CID109108564
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC NameN-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cncc(C(=O)N2c3ccccc3CC2C)c1)c1ccccc1
InChIInChI=1S/C24H23N3O2/c1-3-26(21-10-5-4-6-11-21)23(28)19-14-20(16-25-15-19)24(29)27-17(2)13-18-9-7-8-12-22(18)27/h4-12,14-17H,3,13H2,1-2H3
InChIKeyPLAVTAYJVOJPGH-UHFFFAOYSA-N
XLogP4.34
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide?
The IUPAC name of N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide (CID 109108564) is N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide?
The canonical SMILES for N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide is CCN(C(=O)c1cncc(C(=O)N2c3ccccc3CC2C)c1)c1ccccc1.
What is the InChIKey of N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide?
The InChIKey is PLAVTAYJVOJPGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-3-26(21-10-5-4-6-11-21)23(28)19-14-20(16-25-15-19)24(29)27-17(2)13-18-9-7-8-12-22(18)27/h4-12,14-17H,3,13H2,1-2H3.
What are the key properties of N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide?
N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109108564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).