8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene

C15H19F — CID 171828637

IUPAC8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene
SMILESCCc1c(F)ccc2c1=C(C(C)C)CCC=2
InChIInChI=1S/C15H19F/c1-4-12-14(16)9-8-11-6-5-7-13(10(2)3)15(11)12/h6,8-10H,4-5,7H2,1-3H3
InChIKeyXCBGEXZXVXQAKJ-UHFFFAOYSA-N
MW218.31 g/mol
LogP2.77
Rot. Bonds2

About 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene

8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene (PubChem CID 171828637) has the molecular formula C15H19F and a molecular weight of 218.31 g/mol. Its IUPAC name is 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene.

Molecular Properties

Compound Name8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene
PubChem CID171828637
Molecular FormulaC15H19F
Molecular Weight218.31 g/mol
Exact Mass218.15
IUPAC Name8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene
SMILESCCc1c(F)ccc2c1=C(C(C)C)CCC=2
InChIInChI=1S/C15H19F/c1-4-12-14(16)9-8-11-6-5-7-13(10(2)3)15(11)12/h6,8-10H,4-5,7H2,1-3H3
InChIKeyXCBGEXZXVXQAKJ-UHFFFAOYSA-N
XLogP2.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.31
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene
CID 169127783
3-fluoro-2-methyl-1-propan-2-ylcyclohexa-1,3-diene
CID 145369202
2-ethyl-1,3-di(propan-2-yl)cyclohexa-1,3-diene
CID 153335086
6-bromo-2-ethyl-3-fluorophenol
CID 130713861
1-(2-ethyl-3,4-difluorophenyl)ethanamine
CID 55271184
2-bromo-1-(bromomethyl)-3-ethyl-4-fluorobenzene
CID 130140582
2-ethyl-1,3-difluoro-4-iodobenzene
CID 149278031
1,2-difluoro-4-propan-2-ylbenzene;propane
CID 143774679
5-ethyl-6-fluoro-2-propan-2-ylcyclohexa-1,5-dien-1-amine
CID 172585884
propan-2-yl 2-ethyl-3,6-difluorobenzenesulfonate
CID 22910434
1-ethyl-2-fluoronaphthalene
CID 19065482
2,6-di(propan-2-yl)cyclohexa-1,5-dien-1-amine
CID 70666053

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene?
The IUPAC name of 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene (CID 171828637) is 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene.
What is the SMILES notation for 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene?
The canonical SMILES for 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene is CCc1c(F)ccc2c1=C(C(C)C)CCC=2.
What is the InChIKey of 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene?
The InChIKey is XCBGEXZXVXQAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F/c1-4-12-14(16)9-8-11-6-5-7-13(10(2)3)15(11)12/h6,8-10H,4-5,7H2,1-3H3.
What are the key properties of 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene?
8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene has a molecular weight of 218.31 g/mol, XLogP of 2.77, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene is sourced from PubChem (CID 171828637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).