2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine

C13H17ClN2O — CID 84634763

IUPAC2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine
SMILESCNCCc1cc2cc(OC)c(Cl)cc2n1C
InChIInChI=1S/C13H17ClN2O/c1-15-5-4-10-6-9-7-13(17-3)11(14)8-12(9)16(10)2/h6-8,15H,4-5H2,1-3H3
InChIKeyZIZFBYYZPZTADS-UHFFFAOYSA-N
MW252.74 g/mol
LogP2.60
Rot. Bonds4

About 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine

2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine (PubChem CID 84634763) has the molecular formula C13H17ClN2O and a molecular weight of 252.74 g/mol. Its IUPAC name is 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine
PubChem CID84634763
Molecular FormulaC13H17ClN2O
Molecular Weight252.74 g/mol
Exact Mass252.10
IUPAC Name2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine
SMILESCNCCc1cc2cc(OC)c(Cl)cc2n1C
InChIInChI=1S/C13H17ClN2O/c1-15-5-4-10-6-9-7-13(17-3)11(14)8-12(9)16(10)2/h6-8,15H,4-5H2,1-3H3
InChIKeyZIZFBYYZPZTADS-UHFFFAOYSA-N
XLogP2.60
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.74
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine 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

N-[(6-chloro-5-methoxy-1-methylindol-2-yl)methyl]propan-2-amine
CID 84640295
2-(7-methoxy-1,5-dimethylindol-2-yl)-N-methylethanamine
CID 84627085
2-(3-bromo-6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine
CID 84646347
2-(4-chloro-7-methoxy-1-methylindol-2-yl)-N-methylethanamine
CID 84634780
2-(2,4-dichloro-5-methoxyphenyl)-N-methylethanamine
CID 83895894
2-(7-chloro-6-methoxy-1-methyl-2-oxoquinolin-3-yl)acetic acid
CID 84642929
6-chloro-5-methoxy-1-methyl-2-pyrrolidin-2-ylindole
CID 84639752
3-(6-chloro-5-methoxy-2-methylindol-1-yl)propan-1-amine
CID 82499498
1-methyl-2-[3-(methylamino)propyl]indol-5-ol
CID 117195354
N-methyl-2-(1,6,7-trimethylindol-2-yl)ethanamine
CID 84622439
2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine
CID 82251405
1-methyl-2-[2-(methylamino)ethyl]indol-7-ol
CID 117197124

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine?
The IUPAC name of 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine (CID 84634763) is 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine is CNCCc1cc2cc(OC)c(Cl)cc2n1C.
What is the InChIKey of 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine?
The InChIKey is ZIZFBYYZPZTADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O/c1-15-5-4-10-6-9-7-13(17-3)11(14)8-12(9)16(10)2/h6-8,15H,4-5H2,1-3H3.
What are the key properties of 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine?
2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine has a molecular weight of 252.74 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-5-methoxy-1-methylindol-2-yl)-N-methylethanamine is sourced from PubChem (CID 84634763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).