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

C14H17F — CID 169127783

IUPAC7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene
SMILESCc1c(F)ccc2c1=C(C(C)C)CCC=2
InChIInChI=1S/C14H17F/c1-9(2)12-6-4-5-11-7-8-13(15)10(3)14(11)12/h5,7-9H,4,6H2,1-3H3
InChIKeyYLSJXISKSXITDL-UHFFFAOYSA-N
MW204.29 g/mol
LogP2.52
Rot. Bonds1

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

7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene (PubChem CID 169127783) has the molecular formula C14H17F and a molecular weight of 204.29 g/mol. Its IUPAC name is 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene.

Molecular Properties

Compound Name7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene
PubChem CID169127783
Molecular FormulaC14H17F
Molecular Weight204.29 g/mol
Exact Mass204.13
IUPAC Name7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene
SMILESCc1c(F)ccc2c1=C(C(C)C)CCC=2
InChIInChI=1S/C14H17F/c1-9(2)12-6-4-5-11-7-8-13(15)10(3)14(11)12/h5,7-9H,4,6H2,1-3H3
InChIKeyYLSJXISKSXITDL-UHFFFAOYSA-N
XLogP2.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

8-ethyl-7-fluoro-1-propan-2-yl-2,3-dihydronaphthalene
CID 171828637
3-fluoro-2-methyl-1-propan-2-ylcyclohexa-1,3-diene
CID 145369202
2,6-di(propan-2-yl)cyclohexa-1,5-dien-1-amine
CID 70666053
(4-fluoro-3-methyl-2-propan-2-ylphenyl)phosphane
CID 143190268
1,3-difluoro-2-methylbenzene;2-methylpropane
CID 159186577
3-(difluoromethyl)-1-fluoro-2,4-dimethylbenzene
CID 131096553
2-ethyl-1,3-di(propan-2-yl)cyclohexa-1,3-diene
CID 153335086
1-(2-chloro-4-fluoro-3-methylphenyl)ethanol
CID 130090893
2-(4-fluoro-3-methylphenyl)cyclopent-2-en-1-one
CID 11469549
3-chloro-1-methyl-2-propan-2-ylcyclohexa-1,3-diene
CID 153352774
1-(2,4-difluoro-3-methylphenyl)ethanethiol
CID 155399048
1-(2,4-difluoro-3-methylphenyl)ethanol
CID 84654323

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene?
The IUPAC name of 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene (CID 169127783) is 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene.
What is the SMILES notation for 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene?
The canonical SMILES for 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene is Cc1c(F)ccc2c1=C(C(C)C)CCC=2.
What is the InChIKey of 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene?
The InChIKey is YLSJXISKSXITDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F/c1-9(2)12-6-4-5-11-7-8-13(15)10(3)14(11)12/h5,7-9H,4,6H2,1-3H3.
What are the key properties of 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene?
7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene has a molecular weight of 204.29 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-8-methyl-1-propan-2-yl-2,3-dihydronaphthalene is sourced from PubChem (CID 169127783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).