3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene

C11H13FO — CID 84718386

IUPAC3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene
SMILESCOc1ccc2c(c1)CCC2(C)F
InChIInChI=1S/C11H13FO/c1-11(12)6-5-8-7-9(13-2)3-4-10(8)11/h3-4,7H,5-6H2,1-2H3
InChIKeyZWFHFURFZDYQSL-UHFFFAOYSA-N
MW180.22 g/mol
LogP2.83
Rot. Bonds1

About 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene

3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene (PubChem CID 84718386) has the molecular formula C11H13FO and a molecular weight of 180.22 g/mol. Its IUPAC name is 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene.

Molecular Properties

Compound Name3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene
PubChem CID84718386
Molecular FormulaC11H13FO
Molecular Weight180.22 g/mol
Exact Mass180.10
IUPAC Name3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene
SMILESCOc1ccc2c(c1)CCC2(C)F
InChIInChI=1S/C11H13FO/c1-11(12)6-5-8-7-9(13-2)3-4-10(8)11/h3-4,7H,5-6H2,1-2H3
InChIKeyZWFHFURFZDYQSL-UHFFFAOYSA-N
XLogP2.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methoxy-3,3-dimethyl-1,2-dihydroindene
CID 22152285
7-methoxy-4-methyl-4-phenyl-2,3-dihydro-1H-naphthalene
CID 102291297
6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]
CID 82277020
7-methoxy-2-methyl-3,4-dihydro-1H-naphthalen-2-amine
CID 84719792
ethane;6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalene
CID 143044836
5-iodo-8-methoxy-5-methyl-1,2,3,4-tetrahydro-3-benzazepine
CID 67206648
methyl 1-amino-5-methoxy-2,3-dihydroindene-1-carboxylate
CID 83910529
8-chloro-2-fluoro-6-methoxy-2-methyl-3,4-dihydronaphthalen-1-one
CID 167238637
8-methoxy-5,5-dimethyl-2,3-dihydro-1H-3-benzazepin-4-one
CID 168876558
1-(2,5-dimethoxyphenyl)-5-fluoro-2,3-dihydroinden-1-ol
CID 116531723
1-(cyanomethyl)-5-methoxy-2,3-dihydroindene-1-carbonitrile
CID 12938512
5-methoxy-2-methyl-1,3-dihydroinden-2-amine
CID 84717968

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene?
The IUPAC name of 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene (CID 84718386) is 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene.
What is the SMILES notation for 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene?
The canonical SMILES for 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene is COc1ccc2c(c1)CCC2(C)F.
What is the InChIKey of 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene?
The InChIKey is ZWFHFURFZDYQSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO/c1-11(12)6-5-8-7-9(13-2)3-4-10(8)11/h3-4,7H,5-6H2,1-2H3.
What are the key properties of 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene?
3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene has a molecular weight of 180.22 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene is sourced from PubChem (CID 84718386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).