6-fluoro-2,2-dimethyl-1,3-dihydroindole

C10H12FN — CID 84717066

IUPAC6-fluoro-2,2-dimethyl-1,3-dihydroindole
SMILESCC1(C)Cc2ccc(F)cc2N1
InChIInChI=1S/C10H12FN/c1-10(2)6-7-3-4-8(11)5-9(7)12-10/h3-5,12H,6H2,1-2H3
InChIKeyZNAGUPDDCAVCTR-UHFFFAOYSA-N
MW165.21 g/mol
LogP2.57
Rot. Bonds

About 6-fluoro-2,2-dimethyl-1,3-dihydroindole

6-fluoro-2,2-dimethyl-1,3-dihydroindole (PubChem CID 84717066) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is 6-fluoro-2,2-dimethyl-1,3-dihydroindole.

Molecular Properties

Compound Name6-fluoro-2,2-dimethyl-1,3-dihydroindole
PubChem CID84717066
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name6-fluoro-2,2-dimethyl-1,3-dihydroindole
SMILESCC1(C)Cc2ccc(F)cc2N1
InChIInChI=1S/C10H12FN/c1-10(2)6-7-3-4-8(11)5-9(7)12-10/h3-5,12H,6H2,1-2H3
InChIKeyZNAGUPDDCAVCTR-UHFFFAOYSA-N
XLogP2.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(6-fluoro-2-methyl-1,3-dihydroindol-2-yl)methanol
CID 117193573
6-chloro-2,2-dimethyl-1,3-dihydroindole
CID 84718600
6-fluorospiro[1,3-dihydroindole-2,4'-piperidine]
CID 105459074
2,2-dimethyl-1,3-dihydroindole;ethane
CID 90930598
(4R)-7-fluoro-2,2,4-trimethyl-3,4-dihydro-1H-quinoline
CID 97297931
7-fluoro-1,4-dihydro-3,1-benzoxazine-2-thione
CID 84768962
1-cycloheptyl-2-(7-fluoro-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanone
CID 69214401
4-fluoro-2,2-dimethyl-1,3-dihydroindole
CID 84717067
2,2-dimethyl-1,3-dihydroindole-5-carboxylic acid
CID 57324652
3,8-difluoro-6,11-dihydro-5H-benzo[b][1]benzazepine
CID 10609540
2,2-dimethyl-1,3-dihydroindole-5-carboxamide
CID 174931902
1-(7-fluoro-3,3-dimethyl-2,4-dihydroquinoxalin-1-yl)ethanone
CID 82392213

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2,2-dimethyl-1,3-dihydroindole?
The IUPAC name of 6-fluoro-2,2-dimethyl-1,3-dihydroindole (CID 84717066) is 6-fluoro-2,2-dimethyl-1,3-dihydroindole.
What is the SMILES notation for 6-fluoro-2,2-dimethyl-1,3-dihydroindole?
The canonical SMILES for 6-fluoro-2,2-dimethyl-1,3-dihydroindole is CC1(C)Cc2ccc(F)cc2N1.
What is the InChIKey of 6-fluoro-2,2-dimethyl-1,3-dihydroindole?
The InChIKey is ZNAGUPDDCAVCTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN/c1-10(2)6-7-3-4-8(11)5-9(7)12-10/h3-5,12H,6H2,1-2H3.
What are the key properties of 6-fluoro-2,2-dimethyl-1,3-dihydroindole?
6-fluoro-2,2-dimethyl-1,3-dihydroindole has a molecular weight of 165.21 g/mol, XLogP of 2.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2,2-dimethyl-1,3-dihydroindole is sourced from PubChem (CID 84717066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).