2,2-dimethylindole

C10H11N — CID 118895263

IUPAC2,2-dimethylindole
SMILESCC1(C)C=c2ccccc2=N1
InChIInChI=1S/C10H11N/c1-10(2)7-8-5-3-4-6-9(8)11-10/h3-7H,1-2H3
InChIKeySKQIDQDRNMKHQK-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.88
Rot. Bonds

About 2,2-dimethylindole

2,2-dimethylindole (PubChem CID 118895263) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 2,2-dimethylindole.

Molecular Properties

Compound Name2,2-dimethylindole
PubChem CID118895263
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name2,2-dimethylindole
SMILESCC1(C)C=c2ccccc2=N1
InChIInChI=1S/C10H11N/c1-10(2)7-8-5-3-4-6-9(8)11-10/h3-7H,1-2H3
InChIKeySKQIDQDRNMKHQK-UHFFFAOYSA-N
XLogP0.88
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8aH-carbazole
CID 9548747
2,2-Dimethyl-2H-benzimidazole
CID 11435022
2H-Indole
CID 19013146
4H-Carbazole
CID 19360791
2H-carbazole
CID 19830578
Methyleneindole
CID 20077160
Indole-2-thione
CID 21864376
Cyclopentacarbazole
CID 21887528
2-Methylindol-2-ylium
CID 57054412
2-methyl-2H-indole
CID 58371059
Trimethyl 2h indol
CID 101318478
2-Methylindolethiol
CID 129741743

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylindole?
The IUPAC name of 2,2-dimethylindole (CID 118895263) is 2,2-dimethylindole.
What is the SMILES notation for 2,2-dimethylindole?
The canonical SMILES for 2,2-dimethylindole is CC1(C)C=c2ccccc2=N1.
What is the InChIKey of 2,2-dimethylindole?
The InChIKey is SKQIDQDRNMKHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-10(2)7-8-5-3-4-6-9(8)11-10/h3-7H,1-2H3.
What are the key properties of 2,2-dimethylindole?
2,2-dimethylindole has a molecular weight of 145.20 g/mol, XLogP of 0.88, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylindole is sourced from PubChem (CID 118895263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).