6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole

C22H25ClN4 — CID 22462261

IUPAC6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole
SMILESClc1ccc2c(CCN3CCN(c4cccc5c4CCN5)CC3)c[nH]c2c1
InChIInChI=1S/C22H25ClN4/c23-17-4-5-18-16(15-25-21(18)14-17)7-9-26-10-12-27(13-11-26)22-3-1-2-20-19(22)6-8-24-20/h1-5,14-15,24-25H,6-13H2
InChIKeyUUUUNNHHDJJTRF-UHFFFAOYSA-N
MW380.92 g/mol
LogP4.15
Rot. Bonds4

About 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole

6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole (PubChem CID 22462261) has the molecular formula C22H25ClN4 and a molecular weight of 380.92 g/mol. Its IUPAC name is 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole.

Molecular Properties

Compound Name6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole
PubChem CID22462261
Molecular FormulaC22H25ClN4
Molecular Weight380.92 g/mol
Exact Mass380.18
IUPAC Name6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole
SMILESClc1ccc2c(CCN3CCN(c4cccc5c4CCN5)CC3)c[nH]c2c1
InChIInChI=1S/C22H25ClN4/c23-17-4-5-18-16(15-25-21(18)14-17)7-9-26-10-12-27(13-11-26)22-3-1-2-20-19(22)6-8-24-20/h1-5,14-15,24-25H,6-13H2
InChIKeyUUUUNNHHDJJTRF-UHFFFAOYSA-N
XLogP4.15
TPSA34.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.92
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole?
The IUPAC name of 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole (CID 22462261) is 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole.
What is the SMILES notation for 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole?
The canonical SMILES for 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole is Clc1ccc2c(CCN3CCN(c4cccc5c4CCN5)CC3)c[nH]c2c1.
What is the InChIKey of 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole?
The InChIKey is UUUUNNHHDJJTRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN4/c23-17-4-5-18-16(15-25-21(18)14-17)7-9-26-10-12-27(13-11-26)22-3-1-2-20-19(22)6-8-24-20/h1-5,14-15,24-25H,6-13H2.
What are the key properties of 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole?
6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole has a molecular weight of 380.92 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-[2-[4-(2,3-dihydro-1H-indol-4-yl)piperazin-1-yl]ethyl]-1H-indole is sourced from PubChem (CID 22462261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).