2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine

C10H10BrClN2 — CID 84641985

IUPAC2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine
SMILESNCCc1[nH]c2c(Cl)cccc2c1Br
InChIInChI=1S/C10H10BrClN2/c11-9-6-2-1-3-7(12)10(6)14-8(9)4-5-13/h1-3,14H,4-5,13H2
InChIKeyIHXBLLOKRBJEFF-UHFFFAOYSA-N
MW273.56 g/mol
LogP3.09
Rot. Bonds2

About 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine

2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine (PubChem CID 84641985) has the molecular formula C10H10BrClN2 and a molecular weight of 273.56 g/mol. Its IUPAC name is 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine
PubChem CID84641985
Molecular FormulaC10H10BrClN2
Molecular Weight273.56 g/mol
Exact Mass271.97
IUPAC Name2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine
SMILESNCCc1[nH]c2c(Cl)cccc2c1Br
InChIInChI=1S/C10H10BrClN2/c11-9-6-2-1-3-7(12)10(6)14-8(9)4-5-13/h1-3,14H,4-5,13H2
InChIKeyIHXBLLOKRBJEFF-UHFFFAOYSA-N
XLogP3.09
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.56
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-bromo-7-chloro-1H-indol-2-yl)methanol
CID 115048681
2,3-dibromo-7-chloro-1H-indole
CID 12706664
2-(3-bromo-1H-indol-2-yl)ethanamine
CID 84629371
(7-chloro-3-ethyl-1H-indol-2-yl)methanamine
CID 84621210
2-[7-chloro-2-(trifluoromethyl)-1H-indol-3-yl]ethanamine
CID 59173221
3-bromo-7-chloro-1H-indole-2-carboxylic acid
CID 84810523
1-(7-chloro-2-ethyl-1H-indol-3-yl)propan-1-amine
CID 107431884
3-(7-chloro-3-methyl-1H-indol-2-yl)-2-methylpropan-1-amine
CID 83868277
2-(3-bromo-4,7-dimethyl-1H-indol-2-yl)ethanamine
CID 84640405
2-(6,7-dichloro-3-iodo-1H-indol-2-yl)ethanamine
CID 170427465
7-chloro-3-iodo-2-methyl-1H-indole
CID 130049382
4-[2-(4-tert-butylphenyl)-7-chloro-1H-indol-3-yl]butan-1-amine
CID 4574426

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine?
The IUPAC name of 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine (CID 84641985) is 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine.
What is the SMILES notation for 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine?
The canonical SMILES for 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine is NCCc1[nH]c2c(Cl)cccc2c1Br.
What is the InChIKey of 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine?
The InChIKey is IHXBLLOKRBJEFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrClN2/c11-9-6-2-1-3-7(12)10(6)14-8(9)4-5-13/h1-3,14H,4-5,13H2.
What are the key properties of 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine?
2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine has a molecular weight of 273.56 g/mol, XLogP of 3.09, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-7-chloro-1H-indol-2-yl)ethanamine is sourced from PubChem (CID 84641985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).