2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine

C11H15ClN2 — CID 83868700

IUPAC2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine
SMILESCN1c2ccc(Cl)cc2CC1CCN
InChIInChI=1S/C11H15ClN2/c1-14-10(4-5-13)7-8-6-9(12)2-3-11(8)14/h2-3,6,10H,4-5,7,13H2,1H3
InChIKeyJDQPCLRRBDCYTJ-UHFFFAOYSA-N
MW210.71 g/mol
LogP2.05
Rot. Bonds2

About 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine

2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine (PubChem CID 83868700) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine
PubChem CID83868700
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine
SMILESCN1c2ccc(Cl)cc2CC1CCN
InChIInChI=1S/C11H15ClN2/c1-14-10(4-5-13)7-8-6-9(12)2-3-11(8)14/h2-3,6,10H,4-5,7,13H2,1H3
InChIKeyJDQPCLRRBDCYTJ-UHFFFAOYSA-N
XLogP2.05
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)-N-methylpropan-1-amine
CID 117201111
2-(7-chloro-1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
CID 84624761
5-chloro-1-methyl-2-(piperazin-1-ylmethyl)-2,3-dihydroindole
CID 117201093
(5-chloro-1-propan-2-yl-2,3-dihydroindol-2-yl)methanamine
CID 83868738
2-(6-tert-butyl-1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
CID 84632621
2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
CID 84618930
2-[1-ethyl-5-(trifluoromethyl)-2,3-dihydroindol-2-yl]ethanamine
CID 117200697
2-(1,4,7-trimethyl-2,3-dihydroquinoxalin-2-yl)ethanamine
CID 84623417
3-(5-chloro-1-propan-2-yl-2,3-dihydroindol-2-yl)-2-methylpropanoic acid
CID 117201259
2-[1-(4-chloro-2-methylphenyl)piperidin-4-yl]ethanamine
CID 82298380
3-(5-methoxy-1-methyl-2,3-dihydroindol-2-yl)-N-methylpropan-1-amine
CID 117201453
O-[[(3S)-6-chloro-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl]methyl] carbamothioate
CID 10221100

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine?
The IUPAC name of 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine (CID 83868700) is 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine.
What is the SMILES notation for 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine?
The canonical SMILES for 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine is CN1c2ccc(Cl)cc2CC1CCN.
What is the InChIKey of 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine?
The InChIKey is JDQPCLRRBDCYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c1-14-10(4-5-13)7-8-6-9(12)2-3-11(8)14/h2-3,6,10H,4-5,7,13H2,1H3.
What are the key properties of 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine?
2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine has a molecular weight of 210.71 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1-methyl-2,3-dihydroindol-2-yl)ethanamine is sourced from PubChem (CID 83868700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).