N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide

C21H25N3O — CID 110683519

IUPACN-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide
SMILESCCN(CCc1ccncc1)C(=O)CCc1c(C)[nH]c2ccccc12
InChIInChI=1S/C21H25N3O/c1-3-24(15-12-17-10-13-22-14-11-17)21(25)9-8-18-16(2)23-20-7-5-4-6-19(18)20/h4-7,10-11,13-14,23H,3,8-9,12,15H2,1-2H3
InChIKeyADILYSOZVVJUNA-UHFFFAOYSA-N
MW335.45 g/mol
LogP3.90
Rot. Bonds7

About N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide

N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide (PubChem CID 110683519) has the molecular formula C21H25N3O and a molecular weight of 335.45 g/mol. Its IUPAC name is N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide
PubChem CID110683519
Molecular FormulaC21H25N3O
Molecular Weight335.45 g/mol
Exact Mass335.20
IUPAC NameN-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide
SMILESCCN(CCc1ccncc1)C(=O)CCc1c(C)[nH]c2ccccc12
InChIInChI=1S/C21H25N3O/c1-3-24(15-12-17-10-13-22-14-11-17)21(25)9-8-18-16(2)23-20-7-5-4-6-19(18)20/h4-7,10-11,13-14,23H,3,8-9,12,15H2,1-2H3
InChIKeyADILYSOZVVJUNA-UHFFFAOYSA-N
XLogP3.90
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide 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

3-amino-N-ethyl-N-(2-pyridin-4-ylethyl)propanamide
CID 22692037
N-ethyl-2-oxo-N-(2-pyridin-4-ylethyl)-1H-quinoline-4-carboxamide
CID 110694438
N-ethyl-2-oxo-N-(2-pyridin-4-ylethyl)-1H-quinazoline-4-carboxamide
CID 110702531
N-ethyl-N-(2-pyridin-4-ylethyl)pentanamide
CID 110755648
3-tert-butyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea
CID 2157740
N-ethyl-3-imidazo[1,5-a]pyridin-3-yl-N-(2-pyridin-4-ylethyl)propanamide
CID 110675045
2-[ethyl-[2-(2-methyl-1H-indol-3-yl)acetyl]amino]acetic acid
CID 61022230
N,N,N'-triethyl-N'-(2-pyridin-4-ylethyl)oxamide
CID 108526067
1-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-(3-methylphenyl)-1-(pyridin-4-ylmethyl)thiourea
CID 2157752
5-(2-methyl-1H-indol-3-yl)pentan-2-one
CID 116927762
3-(2,5-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea
CID 2157756
3-(2,4-dimethylphenyl)-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea
CID 2157758

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide?
The IUPAC name of N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide (CID 110683519) is N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide.
What is the SMILES notation for N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide?
The canonical SMILES for N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide is CCN(CCc1ccncc1)C(=O)CCc1c(C)[nH]c2ccccc12.
What is the InChIKey of N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide?
The InChIKey is ADILYSOZVVJUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O/c1-3-24(15-12-17-10-13-22-14-11-17)21(25)9-8-18-16(2)23-20-7-5-4-6-19(18)20/h4-7,10-11,13-14,23H,3,8-9,12,15H2,1-2H3.
What are the key properties of N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide?
N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide has a molecular weight of 335.45 g/mol, XLogP of 3.90, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-methyl-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)propanamide is sourced from PubChem (CID 110683519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).