3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole

C17H25N3 — CID 80574811

IUPAC3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole
SMILESc1ccc2c(c1)NCC2CCN1CCN(C2CC2)CC1
InChIInChI=1S/C17H25N3/c1-2-4-17-16(3-1)14(13-18-17)7-8-19-9-11-20(12-10-19)15-5-6-15/h1-4,14-15,18H,5-13H2
InChIKeyIPEWLNSCCOUWKC-UHFFFAOYSA-N
MW271.41 g/mol
LogP2.37
Rot. Bonds4

About 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole

3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole (PubChem CID 80574811) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole
PubChem CID80574811
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC Name3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole
SMILESc1ccc2c(c1)NCC2CCN1CCN(C2CC2)CC1
InChIInChI=1S/C17H25N3/c1-2-4-17-16(3-1)14(13-18-17)7-8-19-9-11-20(12-10-19)15-5-6-15/h1-4,14-15,18H,5-13H2
InChIKeyIPEWLNSCCOUWKC-UHFFFAOYSA-N
XLogP2.37
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-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

Related Compounds

3-[(4-cyclopentylpiperazin-1-yl)methyl]-2,3-dihydro-1H-indole
CID 80565820
3-[2-(4-tert-butylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574620
3-[2-(3-ethylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80576591
3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574822
7-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
CID 80575135
3-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-2,3-dihydro-1H-indole
CID 80565688
5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole
CID 68855989
1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]pyrrolidin-2-one
CID 24700363
3-[2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-2,3-dihydro-1H-indole
CID 114490137
2-(2,3-dihydro-1H-indol-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 80577284
2-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 24695821
3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 83055716

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The IUPAC name of 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole (CID 80574811) is 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole.
What is the SMILES notation for 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The canonical SMILES for 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole is c1ccc2c(c1)NCC2CCN1CCN(C2CC2)CC1.
What is the InChIKey of 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The InChIKey is IPEWLNSCCOUWKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-2-4-17-16(3-1)14(13-18-17)7-8-19-9-11-20(12-10-19)15-5-6-15/h1-4,14-15,18H,5-13H2.
What are the key properties of 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole?
3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole has a molecular weight of 271.41 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole is sourced from PubChem (CID 80574811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).