1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine

C11H12Cl2N2 — CID 83868253

IUPAC1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine
SMILESCNCc1[nH]c2c(Cl)ccc(Cl)c2c1C
InChIInChI=1S/C11H12Cl2N2/c1-6-9(5-14-2)15-11-8(13)4-3-7(12)10(6)11/h3-4,14-15H,5H2,1-2H3
InChIKeyGLOLHLBNXIEUOK-UHFFFAOYSA-N
MW243.14 g/mol
LogP3.50
Rot. Bonds2

About 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine

1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine (PubChem CID 83868253) has the molecular formula C11H12Cl2N2 and a molecular weight of 243.14 g/mol. Its IUPAC name is 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine
PubChem CID83868253
Molecular FormulaC11H12Cl2N2
Molecular Weight243.14 g/mol
Exact Mass242.04
IUPAC Name1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine
SMILESCNCc1[nH]c2c(Cl)ccc(Cl)c2c1C
InChIInChI=1S/C11H12Cl2N2/c1-6-9(5-14-2)15-11-8(13)4-3-7(12)10(6)11/h3-4,14-15H,5H2,1-2H3
InChIKeyGLOLHLBNXIEUOK-UHFFFAOYSA-N
XLogP3.50
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.14
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-chloro-2,7-dimethyl-1H-indol-3-yl)-N-methylmethanamine
CID 83868286
(4-chloro-7-methoxy-3-methyl-1H-indol-2-yl)methanamine
CID 83868244
3-(4-chloro-7-methoxy-3-methyl-1H-indol-2-yl)propanenitrile
CID 84633289
8-chloro-2-ethyl-3,5-dimethyl-1H-quinolin-4-one
CID 107628016
N-methyl-1-(3,5,7-trimethyl-1H-indol-2-yl)methanamine
CID 83859630
1-(6-chloro-2,3-dimethylphenyl)-N-methylmethanamine
CID 84659371
N-methyl-2-(3,4,7-trimethyl-1H-indol-2-yl)ethanamine
CID 84622477
5-chloro-2-ethyl-3,8-dimethyl-1H-quinolin-4-one
CID 63561110
1-(3-chloro-6-fluoro-2-methylphenyl)-N-methylmethanamine
CID 84770592
3-(7-chloro-4-methoxy-2-methyl-1H-indol-3-yl)-N-methylpropan-1-amine
CID 96678727
5,8-dichloro-2-methyl-1H-quinazoline-4-thione
CID 107051744
1-(7-chloro-2,3-dimethyl-1H-indol-5-yl)-N-methylmethanamine
CID 83890988

Frequently Asked Questions

What is the IUPAC name of 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine (CID 83868253) is 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine is CNCc1[nH]c2c(Cl)ccc(Cl)c2c1C.
What is the InChIKey of 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine?
The InChIKey is GLOLHLBNXIEUOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Cl2N2/c1-6-9(5-14-2)15-11-8(13)4-3-7(12)10(6)11/h3-4,14-15H,5H2,1-2H3.
What are the key properties of 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine?
1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine has a molecular weight of 243.14 g/mol, XLogP of 3.50, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,7-dichloro-3-methyl-1H-indol-2-yl)-N-methylmethanamine is sourced from PubChem (CID 83868253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).