2-chloro-N-(2-indol-1-ylethyl)aniline

C16H15ClN2 — CID 55195314

IUPAC2-chloro-N-(2-indol-1-ylethyl)aniline
SMILESClc1ccccc1NCCn1ccc2ccccc21
InChIInChI=1S/C16H15ClN2/c17-14-6-2-3-7-15(14)18-10-12-19-11-9-13-5-1-4-8-16(13)19/h1-9,11,18H,10,12H2
InChIKeyLSTJWWIEHINYNK-UHFFFAOYSA-N
MW270.76 g/mol
LogP4.41
Rot. Bonds4

About 2-chloro-N-(2-indol-1-ylethyl)aniline

2-chloro-N-(2-indol-1-ylethyl)aniline (PubChem CID 55195314) has the molecular formula C16H15ClN2 and a molecular weight of 270.76 g/mol. Its IUPAC name is 2-chloro-N-(2-indol-1-ylethyl)aniline.

Molecular Properties

Compound Name2-chloro-N-(2-indol-1-ylethyl)aniline
PubChem CID55195314
Molecular FormulaC16H15ClN2
Molecular Weight270.76 g/mol
Exact Mass270.09
IUPAC Name2-chloro-N-(2-indol-1-ylethyl)aniline
SMILESClc1ccccc1NCCn1ccc2ccccc21
InChIInChI=1S/C16H15ClN2/c17-14-6-2-3-7-15(14)18-10-12-19-11-9-13-5-1-4-8-16(13)19/h1-9,11,18H,10,12H2
InChIKeyLSTJWWIEHINYNK-UHFFFAOYSA-N
XLogP4.41
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[2-(6-chloroindol-1-yl)ethyl]aniline
CID 63504515
2-fluoro-N-(2-indol-1-ylethyl)aniline
CID 62562125
1-[2-(2-chloroanilino)ethyl]quinolin-4-one
CID 62564944
N-(2,3-dichlorophenyl)-3-indol-1-ylpropanamide
CID 84554858
2-chloro-N-(2-pyrrolidin-1-ylethyl)aniline
CID 62573332
5-[2-(2-chloroanilino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735392
N-(2-indol-1-ylethyl)cyclopropanamine
CID 62562475
2-chloro-N-[2-(2-phenylimidazol-1-yl)ethyl]aniline
CID 62565112
2-bromo-N-[2-(6-fluoroindol-1-yl)ethyl]aniline
CID 63505809
2,2,2-trifluoro-N-(2-indol-1-ylethyl)ethanamine
CID 62564217
CID 58655955
CID 58655955
1-(2-fluoroethyl)indole
CID 80694500

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-indol-1-ylethyl)aniline?
The IUPAC name of 2-chloro-N-(2-indol-1-ylethyl)aniline (CID 55195314) is 2-chloro-N-(2-indol-1-ylethyl)aniline.
What is the SMILES notation for 2-chloro-N-(2-indol-1-ylethyl)aniline?
The canonical SMILES for 2-chloro-N-(2-indol-1-ylethyl)aniline is Clc1ccccc1NCCn1ccc2ccccc21.
What is the InChIKey of 2-chloro-N-(2-indol-1-ylethyl)aniline?
The InChIKey is LSTJWWIEHINYNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2/c17-14-6-2-3-7-15(14)18-10-12-19-11-9-13-5-1-4-8-16(13)19/h1-9,11,18H,10,12H2.
What are the key properties of 2-chloro-N-(2-indol-1-ylethyl)aniline?
2-chloro-N-(2-indol-1-ylethyl)aniline has a molecular weight of 270.76 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-indol-1-ylethyl)aniline is sourced from PubChem (CID 55195314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).