6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine

C19H16ClN3 — CID 110433242

IUPAC6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine
SMILESClc1ccc2nccc(NCCc3c[nH]c4ccccc34)c2c1
InChIInChI=1S/C19H16ClN3/c20-14-5-6-18-16(11-14)19(8-10-22-18)21-9-7-13-12-23-17-4-2-1-3-15(13)17/h1-6,8,10-12,23H,7,9H2,(H,21,22)
InChIKeyQOUKJMKLGMLHLO-UHFFFAOYSA-N
MW321.81 g/mol
LogP5.02
Rot. Bonds4

About 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine

6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine (PubChem CID 110433242) has the molecular formula C19H16ClN3 and a molecular weight of 321.81 g/mol. Its IUPAC name is 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine.

Molecular Properties

Compound Name6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine
PubChem CID110433242
Molecular FormulaC19H16ClN3
Molecular Weight321.81 g/mol
Exact Mass321.10
IUPAC Name6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine
SMILESClc1ccc2nccc(NCCc3c[nH]c4ccccc34)c2c1
InChIInChI=1S/C19H16ClN3/c20-14-5-6-18-16(11-14)19(8-10-22-18)21-9-7-13-12-23-17-4-2-1-3-15(13)17/h1-6,8,10-12,23H,7,9H2,(H,21,22)
InChIKeyQOUKJMKLGMLHLO-UHFFFAOYSA-N
XLogP5.02
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.81
LogP ≤ 55.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine 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-chloro-N-[2-(1H-indol-3-yl)ethyl]aniline
CID 171397349
N-[2-(1H-indol-3-yl)ethyl]-1H-indol-3-amine
CID 91539379
N-[2-(6-chloro-1H-indol-3-yl)ethyl]pyrimidin-2-amine
CID 133277622
4-N,6-N-bis[2-(1H-indol-3-yl)ethyl]pyrimidine-4,6-diamine
CID 112862352
4-N-(4-chlorophenyl)-6-N-[2-(1H-indol-3-yl)ethyl]pyrimidine-4,6-diamine
CID 112862383
2-[(7-chloroquinolin-4-yl)amino]-3-(1H-indol-3-yl)propan-1-ol
CID 146126635
3-[2-(2-chloropyrimidin-4-yl)ethyl]-1H-indole
CID 11253902
6-chloro-N-[2-(6-methyl-3-pyridinyl)ethyl]quinolin-4-amine
CID 133361385
N-(2,5-dichlorophenyl)-6-[2-(1H-indol-3-yl)ethylamino]pyrimidine-4-carboxamide
CID 166596732
2-chloro-N-[2-(1H-indol-3-yl)ethyl]quinazolin-4-amine
CID 22692794
2-(5-chloro-1H-indol-3-yl)ethylazanium chloride
CID 11736386
N-(1H-indol-3-ylmethyl)quinolin-5-amine
CID 60680044

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine?
The IUPAC name of 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine (CID 110433242) is 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine.
What is the SMILES notation for 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine?
The canonical SMILES for 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine is Clc1ccc2nccc(NCCc3c[nH]c4ccccc34)c2c1.
What is the InChIKey of 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine?
The InChIKey is QOUKJMKLGMLHLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3/c20-14-5-6-18-16(11-14)19(8-10-22-18)21-9-7-13-12-23-17-4-2-1-3-15(13)17/h1-6,8,10-12,23H,7,9H2,(H,21,22).
What are the key properties of 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine?
6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine has a molecular weight of 321.81 g/mol, XLogP of 5.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(1H-indol-3-yl)ethyl]quinolin-4-amine is sourced from PubChem (CID 110433242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).