7-chloro-3-(2-cyclopentylethyl)-1H-indole

C15H18ClN — CID 106984980

IUPAC7-chloro-3-(2-cyclopentylethyl)-1H-indole
SMILESClc1cccc2c(CCC3CCCC3)c[nH]c12
InChIInChI=1S/C15H18ClN/c16-14-7-3-6-13-12(10-17-15(13)14)9-8-11-4-1-2-5-11/h3,6-7,10-11,17H,1-2,4-5,8-9H2
InChIKeyNRQATENGAHKGIV-UHFFFAOYSA-N
MW247.77 g/mol
LogP4.94
Rot. Bonds3

About 7-chloro-3-(2-cyclopentylethyl)-1H-indole

7-chloro-3-(2-cyclopentylethyl)-1H-indole (PubChem CID 106984980) has the molecular formula C15H18ClN and a molecular weight of 247.77 g/mol. Its IUPAC name is 7-chloro-3-(2-cyclopentylethyl)-1H-indole.

Molecular Properties

Compound Name7-chloro-3-(2-cyclopentylethyl)-1H-indole
PubChem CID106984980
Molecular FormulaC15H18ClN
Molecular Weight247.77 g/mol
Exact Mass247.11
IUPAC Name7-chloro-3-(2-cyclopentylethyl)-1H-indole
SMILESClc1cccc2c(CCC3CCCC3)c[nH]c12
InChIInChI=1S/C15H18ClN/c16-14-7-3-6-13-12(10-17-15(13)14)9-8-11-4-1-2-5-11/h3,6-7,10-11,17H,1-2,4-5,8-9H2
InChIKeyNRQATENGAHKGIV-UHFFFAOYSA-N
XLogP4.94
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.77
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 57280256
(5R)-5-[(7-chloro-1H-indol-3-yl)methyl]-3-(cyclopentylmethyl)imidazolidine-2,4-dione;(5R)-5-[(7-chloro-1H-indol-3-yl)methyl]-3-(cyclopropylmethyl)imidazolidine-2,4-dione
CID 161010316
N-[2-(7-chloro-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine
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1-[2-(7-chloro-1H-indol-3-yl)ethyl]cyclopropan-1-amine
CID 105495625
(3R)-N-[2-(7-chloro-1H-indol-3-yl)ethyl]piperidine-3-carboxamide
CID 138057346
2-(7-chloro-1H-indol-3-yl)acetonitrile
CID 10559597
2-(7-chloro-1H-indol-3-yl)acetamide
CID 10703607
3-bromo-7-chloro-1H-indole
CID 2763282
7-chloro-3-(1,4-diazepan-1-ylmethyl)-1H-indole
CID 82501403
N-[2-(7-fluoro-1H-indol-3-yl)ethyl]cyclopentanamine
CID 82498246
7-chloro-3-piperidin-4-yl-1H-indole
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CID 106985417

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(2-cyclopentylethyl)-1H-indole?
The IUPAC name of 7-chloro-3-(2-cyclopentylethyl)-1H-indole (CID 106984980) is 7-chloro-3-(2-cyclopentylethyl)-1H-indole.
What is the SMILES notation for 7-chloro-3-(2-cyclopentylethyl)-1H-indole?
The canonical SMILES for 7-chloro-3-(2-cyclopentylethyl)-1H-indole is Clc1cccc2c(CCC3CCCC3)c[nH]c12.
What is the InChIKey of 7-chloro-3-(2-cyclopentylethyl)-1H-indole?
The InChIKey is NRQATENGAHKGIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN/c16-14-7-3-6-13-12(10-17-15(13)14)9-8-11-4-1-2-5-11/h3,6-7,10-11,17H,1-2,4-5,8-9H2.
What are the key properties of 7-chloro-3-(2-cyclopentylethyl)-1H-indole?
7-chloro-3-(2-cyclopentylethyl)-1H-indole has a molecular weight of 247.77 g/mol, XLogP of 4.94, 3 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-(2-cyclopentylethyl)-1H-indole is sourced from PubChem (CID 106984980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).