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

C19H28N2 — CID 80574822

IUPAC3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole
SMILESc1ccc2c(c1)NCC2CCN1CCCC1C1CCCC1
InChIInChI=1S/C19H28N2/c1-2-7-15(6-1)19-10-5-12-21(19)13-11-16-14-20-18-9-4-3-8-17(16)18/h3-4,8-9,15-16,19-20H,1-2,5-7,10-14H2
InChIKeyCWBPPVLWYKKLGP-UHFFFAOYSA-N
MW284.45 g/mol
LogP4.24
Rot. Bonds4

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

3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole (PubChem CID 80574822) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole
PubChem CID80574822
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC Name3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole
SMILESc1ccc2c(c1)NCC2CCN1CCCC1C1CCCC1
InChIInChI=1S/C19H28N2/c1-2-7-15(6-1)19-10-5-12-21(19)13-11-16-14-20-18-9-4-3-8-17(16)18/h3-4,8-9,15-16,19-20H,1-2,5-7,10-14H2
InChIKeyCWBPPVLWYKKLGP-UHFFFAOYSA-N
XLogP4.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(2,5-dimethylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80577266
3-[(2-methylazepan-1-yl)methyl]-2,3-dihydro-1H-indole
CID 80566561
2-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 24695821
3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574811
1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-(2,3-dihydro-1H-indol-3-yl)ethanone
CID 80572891
3-[2-(3-ethylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80576591
3-[2-(4-tert-butylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574620
3-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydro-1H-indole
CID 80567119
2-(2,3-dihydro-1H-indol-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 80577284
3-[(4-cyclopentylpiperazin-1-yl)methyl]-2,3-dihydro-1H-indole
CID 80565820
(6aR,10aS)-5,6,6a,7,8,9,10,10a-octahydrophenanthridine
CID 100962245
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide
CID 79158396

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The IUPAC name of 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole (CID 80574822) is 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole.
What is the SMILES notation for 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The canonical SMILES for 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole is c1ccc2c(c1)NCC2CCN1CCCC1C1CCCC1.
What is the InChIKey of 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The InChIKey is CWBPPVLWYKKLGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-2-7-15(6-1)19-10-5-12-21(19)13-11-16-14-20-18-9-4-3-8-17(16)18/h3-4,8-9,15-16,19-20H,1-2,5-7,10-14H2.
What are the key properties of 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole has a molecular weight of 284.45 g/mol, XLogP of 4.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole is sourced from PubChem (CID 80574822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).