1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone

C18H19N3O — CID 10851277

IUPAC1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone
SMILESCCCN(c1ccncc1)n1cc(C(C)=O)c2ccccc21
InChIInChI=1S/C18H19N3O/c1-3-12-20(15-8-10-19-11-9-15)21-13-17(14(2)22)16-6-4-5-7-18(16)21/h4-11,13H,3,12H2,1-2H3
InChIKeyDFZMRCICMFOMSN-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.92
Rot. Bonds5

About 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone

1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone (PubChem CID 10851277) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone.

Molecular Properties

Compound Name1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone
PubChem CID10851277
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone
SMILESCCCN(c1ccncc1)n1cc(C(C)=O)c2ccccc21
InChIInChI=1S/C18H19N3O/c1-3-12-20(15-8-10-19-11-9-15)21-13-17(14(2)22)16-6-4-5-7-18(16)21/h4-11,13H,3,12H2,1-2H3
InChIKeyDFZMRCICMFOMSN-UHFFFAOYSA-N
XLogP3.92
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone 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

Ibudilast
CID 3671
Jwh 018
CID 10382701
(1-Butyl-1H-indol-3-yl)-1-naphthalenylmethanone
CID 10471670
Jwh 122
CID 44466638
Xlr 11
CID 57501498
(1-(2-(4-Morpholinyl)ethyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
CID 11584525
(4-Ethyl-1-naphthalenyl)(1-pentyl-1H-indol-3-yl)methanone
CID 45270396
AM 2201
CID 53393997
(1-pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
CID 44626619
AM-694
CID 9889172
Jwh 203
CID 44397500
AM-1220, (+-)-
CID 9929889

Frequently Asked Questions

What is the IUPAC name of 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone?
The IUPAC name of 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone (CID 10851277) is 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone.
What is the SMILES notation for 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone?
The canonical SMILES for 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone is CCCN(c1ccncc1)n1cc(C(C)=O)c2ccccc21.
What is the InChIKey of 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone?
The InChIKey is DFZMRCICMFOMSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-3-12-20(15-8-10-19-11-9-15)21-13-17(14(2)22)16-6-4-5-7-18(16)21/h4-11,13H,3,12H2,1-2H3.
What are the key properties of 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone?
1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone has a molecular weight of 293.37 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[propyl(pyridin-4-yl)amino]indol-3-yl]ethanone is sourced from PubChem (CID 10851277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).