(4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone

C21H26N4O — CID 84574669

IUPAC(4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone
SMILESCCN1CCN(C(=O)c2cccnc2N2c3ccccc3CC2C)CC1
InChIInChI=1S/C21H26N4O/c1-3-23-11-13-24(14-12-23)21(26)18-8-6-10-22-20(18)25-16(2)15-17-7-4-5-9-19(17)25/h4-10,16H,3,11-15H2,1-2H3
InChIKeyGPEHEMDBDVWSFW-UHFFFAOYSA-N
MW350.47 g/mol
LogP2.94
Rot. Bonds3

About (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone

(4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone (PubChem CID 84574669) has the molecular formula C21H26N4O and a molecular weight of 350.47 g/mol. Its IUPAC name is (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone.

Molecular Properties

Compound Name(4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone
PubChem CID84574669
Molecular FormulaC21H26N4O
Molecular Weight350.47 g/mol
Exact Mass350.21
IUPAC Name(4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone
SMILESCCN1CCN(C(=O)c2cccnc2N2c3ccccc3CC2C)CC1
InChIInChI=1S/C21H26N4O/c1-3-23-11-13-24(14-12-23)21(26)18-8-6-10-22-20(18)25-16(2)15-17-7-4-5-9-19(17)25/h4-10,16H,3,11-15H2,1-2H3
InChIKeyGPEHEMDBDVWSFW-UHFFFAOYSA-N
XLogP2.94
TPSA39.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.47
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]-(2-methylpiperidin-1-yl)methanone
CID 84574657
(4-ethylpiperazin-1-yl)-[2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]methanone
CID 109367418
N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574698
N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574692
N-(4-fluorophenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574636
N-[3-(dimethylamino)propyl]-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574658
N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574667
[4-(2-hydroxypropyl)piperazin-1-yl]-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 56802486
1-(4-ethylpiperazin-1-yl)-3-(2-methyl-2,3-dihydroindol-1-yl)propan-1-one
CID 109017603
azepan-1-yl-[2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-5-yl]methanone
CID 109264936
[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109181947
N-[[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62286314

Frequently Asked Questions

What is the IUPAC name of (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone?
The IUPAC name of (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone (CID 84574669) is (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone.
What is the SMILES notation for (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone?
The canonical SMILES for (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone is CCN1CCN(C(=O)c2cccnc2N2c3ccccc3CC2C)CC1.
What is the InChIKey of (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone?
The InChIKey is GPEHEMDBDVWSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O/c1-3-23-11-13-24(14-12-23)21(26)18-8-6-10-22-20(18)25-16(2)15-17-7-4-5-9-19(17)25/h4-10,16H,3,11-15H2,1-2H3.
What are the key properties of (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone?
(4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone has a molecular weight of 350.47 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylpiperazin-1-yl)-[2-(2-methyl-2,3-dihydroindol-1-yl)-3-pyridinyl]methanone is sourced from PubChem (CID 84574669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).