5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene

C12H15F — CID 170343572

IUPAC5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene
SMILESCCc1cc2c(cc1CF)CCC2
InChIInChI=1S/C12H15F/c1-2-9-6-10-4-3-5-11(10)7-12(9)8-13/h6-7H,2-5,8H2,1H3
InChIKeySFPJZRCVCFMIJP-UHFFFAOYSA-N
MW178.25 g/mol
LogP3.21
Rot. Bonds2

About 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene

5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene (PubChem CID 170343572) has the molecular formula C12H15F and a molecular weight of 178.25 g/mol. Its IUPAC name is 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene
PubChem CID170343572
Molecular FormulaC12H15F
Molecular Weight178.25 g/mol
Exact Mass178.12
IUPAC Name5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene
SMILESCCc1cc2c(cc1CF)CCC2
InChIInChI=1S/C12H15F/c1-2-9-6-10-4-3-5-11(10)7-12(9)8-13/h6-7H,2-5,8H2,1H3
InChIKeySFPJZRCVCFMIJP-UHFFFAOYSA-N
XLogP3.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.25
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3-ethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 165345844
5-[chloro-(3,4-diethylphenyl)methyl]-2,3-dihydro-1H-indene
CID 115482816
6,7-diethyl-2-methyl-3,4-dihydro-1H-isoquinoline
CID 155395760
4-ethyl-6-(trifluoromethyl)-2,3-dihydro-1H-indene
CID 172602890
5-chloro-2,3-diethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 115483297
2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)ethanesulfonyl chloride
CID 84713994
5,6-diethyl-2,3-dihydroinden-1-one
CID 22238300
2-chloro-3-ethyl-6,7-dihydro-5H-quinolin-8-one
CID 91617307
7-ethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene
CID 70876138
5-ethyl-1,2,3,4-tetrahydroanthracene
CID 141269354
6-(ethoxymethyl)-1,2,3,4-tetrahydronaphthalene
CID 90992767
4-bromo-N-(2,3-dihydro-1H-inden-5-ylmethyl)-2-ethylaniline
CID 81292228

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene?
The IUPAC name of 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene (CID 170343572) is 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene.
What is the SMILES notation for 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene?
The canonical SMILES for 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene is CCc1cc2c(cc1CF)CCC2.
What is the InChIKey of 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene?
The InChIKey is SFPJZRCVCFMIJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F/c1-2-9-6-10-4-3-5-11(10)7-12(9)8-13/h6-7H,2-5,8H2,1H3.
What are the key properties of 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene?
5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene has a molecular weight of 178.25 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-(fluoromethyl)-2,3-dihydro-1H-indene is sourced from PubChem (CID 170343572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).