1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine

C11H13ClN2 — CID 83868177

IUPAC1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine
SMILESCc1c(Cl)ccc2cc(C(C)N)[nH]c12
InChIInChI=1S/C11H13ClN2/c1-6-9(12)4-3-8-5-10(7(2)13)14-11(6)8/h3-5,7,14H,13H2,1-2H3
InChIKeyKBFKFIUOZHFWRU-UHFFFAOYSA-N
MW208.69 g/mol
LogP3.15
Rot. Bonds1

About 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine

1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine (PubChem CID 83868177) has the molecular formula C11H13ClN2 and a molecular weight of 208.69 g/mol. Its IUPAC name is 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine
PubChem CID83868177
Molecular FormulaC11H13ClN2
Molecular Weight208.69 g/mol
Exact Mass208.08
IUPAC Name1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine
SMILESCc1c(Cl)ccc2cc(C(C)N)[nH]c12
InChIInChI=1S/C11H13ClN2/c1-6-9(12)4-3-8-5-10(7(2)13)14-11(6)8/h3-5,7,14H,13H2,1-2H3
InChIKeyKBFKFIUOZHFWRU-UHFFFAOYSA-N
XLogP3.15
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.69
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(6-chloro-7-methyl-1H-indol-2-yl)-N-methylethanamine
CID 83868171
(1R)-1-(6-fluoro-7-methyl-1H-indol-2-yl)ethanamine
CID 55276789
1-(7-chloro-1H-indol-2-yl)ethanamine
CID 65333202
6-chloro-7-methyl-2-(trifluoromethyl)-1H-indole
CID 84627615
(1R)-1-(7-fluoro-1H-indol-2-yl)ethanamine
CID 96742272
(E)-3-(6-chloro-7-methyl-1H-indol-2-yl)prop-2-enamide
CID 170878054
2-(1-aminoethyl)-1H-indole-7-carbonitrile
CID 130001024
7-chloro-8-methyl-2-oxo-1H-quinoline-3-carboxylic acid
CID 6501545
7-chloro-2-propan-2-yl-1H-indole
CID 83637222
6-chloro-7-methyl-2-piperidin-2-yl-1H-indole
CID 84633377
7-chloro-8-methyl-3-phenyl-1H-quinolin-2-one
CID 39346054
2-(1-aminoethyl)-4-chloro-3-methylphenol
CID 84660349

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine?
The IUPAC name of 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine (CID 83868177) is 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine.
What is the SMILES notation for 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine?
The canonical SMILES for 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine is Cc1c(Cl)ccc2cc(C(C)N)[nH]c12.
What is the InChIKey of 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine?
The InChIKey is KBFKFIUOZHFWRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2/c1-6-9(12)4-3-8-5-10(7(2)13)14-11(6)8/h3-5,7,14H,13H2,1-2H3.
What are the key properties of 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine?
1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine has a molecular weight of 208.69 g/mol, XLogP of 3.15, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloro-7-methyl-1H-indol-2-yl)ethanamine is sourced from PubChem (CID 83868177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).