5-fluoro-2,6-dimethyl-1H-indole

C10H10FN — CID 130063636

IUPAC5-fluoro-2,6-dimethyl-1H-indole
SMILESCc1cc2cc(F)c(C)cc2[nH]1
InChIInChI=1S/C10H10FN/c1-6-3-10-8(5-9(6)11)4-7(2)12-10/h3-5,12H,1-2H3
InChIKeyPDDKZWQPDRUVAY-UHFFFAOYSA-N
MW163.19 g/mol
LogP2.92
Rot. Bonds

About 5-fluoro-2,6-dimethyl-1H-indole

5-fluoro-2,6-dimethyl-1H-indole (PubChem CID 130063636) has the molecular formula C10H10FN and a molecular weight of 163.19 g/mol. Its IUPAC name is 5-fluoro-2,6-dimethyl-1H-indole.

Molecular Properties

Compound Name5-fluoro-2,6-dimethyl-1H-indole
PubChem CID130063636
Molecular FormulaC10H10FN
Molecular Weight163.19 g/mol
Exact Mass163.08
IUPAC Name5-fluoro-2,6-dimethyl-1H-indole
SMILESCc1cc2cc(F)c(C)cc2[nH]1
InChIInChI=1S/C10H10FN/c1-6-3-10-8(5-9(6)11)4-7(2)12-10/h3-5,12H,1-2H3
InChIKeyPDDKZWQPDRUVAY-UHFFFAOYSA-N
XLogP2.92
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

6-chloro-5-fluoro-2-methyl-1H-indole
CID 130063681
6-(difluoromethyl)-5-fluoro-2-methyl-1H-indole
CID 166888935
5-fluoro-6-methyl-1H-indole-2-carboxylic acid
CID 22338224
5-fluoro-6-(isocyanatomethyl)-2-methyl-1H-indole
CID 117292389
1-(5-fluoro-2-methyl-1H-indol-6-yl)cyclopropan-1-ol
CID 117293363
5-fluoro-6-methoxy-2-methyl-1H-indole;methyl formate
CID 144996572
5,6-dibromo-2-methyl-1H-indole
CID 130290572
5-fluoro-6-methyl-1H-indole-2-carboxylic acid;methyl 5-fluoro-6-methyl-1H-indole-2-carboxylate
CID 160768064
3-(5-fluoro-2-methyl-1H-indol-6-yl)-1,2-oxazol-5-amine
CID 117333777
1-N'-[(5-fluoro-6-methyl-1H-indol-2-yl)methyl]ethene-1,1-diamine
CID 176926133
6-fluoro-5-methyl-2-phenyl-1H-indole
CID 69096963
5-fluoro-2-methyl-6-(piperidin-2-ylmethyl)-1H-indole
CID 117368408

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2,6-dimethyl-1H-indole?
The IUPAC name of 5-fluoro-2,6-dimethyl-1H-indole (CID 130063636) is 5-fluoro-2,6-dimethyl-1H-indole.
What is the SMILES notation for 5-fluoro-2,6-dimethyl-1H-indole?
The canonical SMILES for 5-fluoro-2,6-dimethyl-1H-indole is Cc1cc2cc(F)c(C)cc2[nH]1.
What is the InChIKey of 5-fluoro-2,6-dimethyl-1H-indole?
The InChIKey is PDDKZWQPDRUVAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN/c1-6-3-10-8(5-9(6)11)4-7(2)12-10/h3-5,12H,1-2H3.
What are the key properties of 5-fluoro-2,6-dimethyl-1H-indole?
5-fluoro-2,6-dimethyl-1H-indole has a molecular weight of 163.19 g/mol, XLogP of 2.92, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2,6-dimethyl-1H-indole is sourced from PubChem (CID 130063636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).