2,6-dichloro-1,3-dimethylindole

C10H9Cl2N — CID 117127818

IUPAC2,6-dichloro-1,3-dimethylindole
SMILESCc1c(Cl)n(C)c2cc(Cl)ccc12
InChIInChI=1S/C10H9Cl2N/c1-6-8-4-3-7(11)5-9(8)13(2)10(6)12/h3-5H,1-2H3
InChIKeyFVTWBXPFXXPAGK-UHFFFAOYSA-N
MW214.09 g/mol
LogP3.79
Rot. Bonds

About 2,6-dichloro-1,3-dimethylindole

2,6-dichloro-1,3-dimethylindole (PubChem CID 117127818) has the molecular formula C10H9Cl2N and a molecular weight of 214.09 g/mol. Its IUPAC name is 2,6-dichloro-1,3-dimethylindole.

Molecular Properties

Compound Name2,6-dichloro-1,3-dimethylindole
PubChem CID117127818
Molecular FormulaC10H9Cl2N
Molecular Weight214.09 g/mol
Exact Mass213.01
IUPAC Name2,6-dichloro-1,3-dimethylindole
SMILESCc1c(Cl)n(C)c2cc(Cl)ccc12
InChIInChI=1S/C10H9Cl2N/c1-6-8-4-3-7(11)5-9(8)13(2)10(6)12/h3-5H,1-2H3
InChIKeyFVTWBXPFXXPAGK-UHFFFAOYSA-N
XLogP3.79
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.09
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(6-chloro-1,3-dimethylindol-2-yl)methanamine
CID 84621214
7-chloro-1,4-dimethyl-2-oxoquinoline-3-carbaldehyde
CID 84628273
7-chloro-1,4-dimethyl-3-propan-2-ylquinolin-2-one
CID 146630321
2-(6-chloro-1,3-dimethylindol-2-yl)propan-1-amine
CID 84628715
(6-chloro-1,2-dimethylindol-3-yl)methanamine
CID 82492537
3-(6-chloro-2,3-dimethylindol-1-yl)propan-1-amine
CID 82496941
2-(6-chloro-1,2-dimethylindol-3-yl)-N,2-dimethylpropan-1-amine
CID 84639810
6-chloro-3-diazonio-1-methylindol-2-olate
CID 135357748
3-(6-chloro-1,2-dimethylindol-3-yl)-3-methylbutan-1-amine
CID 84639811
7-chloro-1-methyl-2-oxoquinoline-4-sulfonyl chloride
CID 170733582
6-chloro-4-methylfuro[3,2-b]indole-2-carbonyl chloride
CID 13405828
1-(3-bromo-6-chloro-1-methylindol-2-yl)-N-methylmethanamine
CID 84643740

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-1,3-dimethylindole?
The IUPAC name of 2,6-dichloro-1,3-dimethylindole (CID 117127818) is 2,6-dichloro-1,3-dimethylindole.
What is the SMILES notation for 2,6-dichloro-1,3-dimethylindole?
The canonical SMILES for 2,6-dichloro-1,3-dimethylindole is Cc1c(Cl)n(C)c2cc(Cl)ccc12.
What is the InChIKey of 2,6-dichloro-1,3-dimethylindole?
The InChIKey is FVTWBXPFXXPAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N/c1-6-8-4-3-7(11)5-9(8)13(2)10(6)12/h3-5H,1-2H3.
What are the key properties of 2,6-dichloro-1,3-dimethylindole?
2,6-dichloro-1,3-dimethylindole has a molecular weight of 214.09 g/mol, XLogP of 3.79, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-1,3-dimethylindole is sourced from PubChem (CID 117127818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).