2-(6,7-dichloro-2-methylindol-1-yl)ethanamine

C11H12Cl2N2 — CID 135333284

IUPAC2-(6,7-dichloro-2-methylindol-1-yl)ethanamine
SMILESCc1cc2ccc(Cl)c(Cl)c2n1CCN
InChIInChI=1S/C11H12Cl2N2/c1-7-6-8-2-3-9(12)10(13)11(8)15(7)5-4-14/h2-3,6H,4-5,14H2,1H3
InChIKeyCPETTYJANRFCKQ-UHFFFAOYSA-N
MW243.14 g/mol
LogP3.22
Rot. Bonds2

About 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine

2-(6,7-dichloro-2-methylindol-1-yl)ethanamine (PubChem CID 135333284) has the molecular formula C11H12Cl2N2 and a molecular weight of 243.14 g/mol. Its IUPAC name is 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(6,7-dichloro-2-methylindol-1-yl)ethanamine
PubChem CID135333284
Molecular FormulaC11H12Cl2N2
Molecular Weight243.14 g/mol
Exact Mass242.04
IUPAC Name2-(6,7-dichloro-2-methylindol-1-yl)ethanamine
SMILESCc1cc2ccc(Cl)c(Cl)c2n1CCN
InChIInChI=1S/C11H12Cl2N2/c1-7-6-8-2-3-9(12)10(13)11(8)15(7)5-4-14/h2-3,6H,4-5,14H2,1H3
InChIKeyCPETTYJANRFCKQ-UHFFFAOYSA-N
XLogP3.22
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.14
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine
CID 3045227
(R,S)-1-(5-chloro-1H-indol-1-yl)propan-2-amine
CID 9855823
8-chloro-1H,2H,3H,4H-pyrazino[1,2-a]indole
CID 14595512
7-chloro-1H,2H,3H,4H-pyrazino[1,2-a]indole
CID 21868720
(R)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine
CID 5745501
6-Chloro-1,2,3,4-tetrahydro-pyrazino[1,2-a]indole
CID 44287208
11-Chloro-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,7-a]indole
CID 20726100
5-Chloro-1,2-dimethyl-3-(1,2,3,6-tetrahydropyridin-4-yl)indole
CID 21512050
6-chloro-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)indole;hydrochloride
CID 127048110
2-(7-Chloro-2-methyl-1H-indol-3-yl)ethanamine
CID 601380
7,8-dichloro-9-methyl-9H-pyrido(3,4-b)indole
CID 189884
(5-Chloro-1H-indol-2-yl)methanamine
CID 4689978

Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine?
The IUPAC name of 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine (CID 135333284) is 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine.
What is the SMILES notation for 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine?
The canonical SMILES for 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine is Cc1cc2ccc(Cl)c(Cl)c2n1CCN.
What is the InChIKey of 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine?
The InChIKey is CPETTYJANRFCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Cl2N2/c1-7-6-8-2-3-9(12)10(13)11(8)15(7)5-4-14/h2-3,6H,4-5,14H2,1H3.
What are the key properties of 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine?
2-(6,7-dichloro-2-methylindol-1-yl)ethanamine has a molecular weight of 243.14 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dichloro-2-methylindol-1-yl)ethanamine is sourced from PubChem (CID 135333284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).