4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene

C15H21F — CID 169145598

IUPAC4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene
SMILESCCCC1(C(C)C)CCc2cccc(F)c21
InChIInChI=1S/C15H21F/c1-4-9-15(11(2)3)10-8-12-6-5-7-13(16)14(12)15/h5-7,11H,4,8-10H2,1-3H3
InChIKeyLLUURLPIAQQZAM-UHFFFAOYSA-N
MW220.33 g/mol
LogP4.47
Rot. Bonds3

About 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene

4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene (PubChem CID 169145598) has the molecular formula C15H21F and a molecular weight of 220.33 g/mol. Its IUPAC name is 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene.

Molecular Properties

Compound Name4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene
PubChem CID169145598
Molecular FormulaC15H21F
Molecular Weight220.33 g/mol
Exact Mass220.16
IUPAC Name4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene
SMILESCCCC1(C(C)C)CCc2cccc(F)c21
InChIInChI=1S/C15H21F/c1-4-9-15(11(2)3)10-8-12-6-5-7-13(16)14(12)15/h5-7,11H,4,8-10H2,1-3H3
InChIKeyLLUURLPIAQQZAM-UHFFFAOYSA-N
XLogP4.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.33
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1-propan-2-yl-2,3-dihydroinden-1-yl)methanol
CID 146230442
8-fluoro-1-(trifluoromethyl)-3,4-dihydro-2H-naphthalen-1-ol
CID 84736450
2-ethyl-8-fluoro-2-methyl-3,4-dihydro-1H-quinoline
CID 84720107
5-fluoro-4-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-naphthalene
CID 84737588
N-[1-(2,6-difluorophenyl)ethyl]propan-1-amine
CID 24691254
3-methyl-3-propyl-1,2-dihydroindene
CID 145156021
2-ethyl-5-fluoro-3,4-dihydro-1H-isoquinoline
CID 58157151
ethyl 2-(5-fluoro-1-hydroxy-3,4-dihydro-2H-naphthalen-1-yl)propanoate
CID 70809294
4,7-difluoro-3-methyl-3-propan-2-yl-1,2-dihydroindene
CID 169145613
2-butan-2-yl-1,3-difluorobenzene
CID 56605716
ethane;2-ethyl-5-fluoro-3,4-dihydro-1H-isoquinoline
CID 143140351
2-(2,6-difluorophenyl)-2-propan-2-ylazepane
CID 79118040

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene?
The IUPAC name of 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene (CID 169145598) is 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene.
What is the SMILES notation for 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene?
The canonical SMILES for 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene is CCCC1(C(C)C)CCc2cccc(F)c21.
What is the InChIKey of 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene?
The InChIKey is LLUURLPIAQQZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F/c1-4-9-15(11(2)3)10-8-12-6-5-7-13(16)14(12)15/h5-7,11H,4,8-10H2,1-3H3.
What are the key properties of 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene?
4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene has a molecular weight of 220.33 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindene is sourced from PubChem (CID 169145598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).