2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane

C10H15FO — CID 163761951

IUPAC2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane
SMILESFC1(OC2CC2)CC2CCC1C2
InChIInChI=1S/C10H15FO/c11-10(12-9-3-4-9)6-7-1-2-8(10)5-7/h7-9H,1-6H2
InChIKeyLYYAIQYWUAOFIV-UHFFFAOYSA-N
MW170.23 g/mol
LogP2.65
Rot. Bonds2

About 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane

2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane (PubChem CID 163761951) has the molecular formula C10H15FO and a molecular weight of 170.23 g/mol. Its IUPAC name is 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane.

Molecular Properties

Compound Name2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane
PubChem CID163761951
Molecular FormulaC10H15FO
Molecular Weight170.23 g/mol
Exact Mass170.11
IUPAC Name2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane
SMILESFC1(OC2CC2)CC2CCC1C2
InChIInChI=1S/C10H15FO/c11-10(12-9-3-4-9)6-7-1-2-8(10)5-7/h7-9H,1-6H2
InChIKeyLYYAIQYWUAOFIV-UHFFFAOYSA-N
XLogP2.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.23
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

exo-2,3-Epoxynorbornane
CID 18463
rel-(1R,2S,4R,5S)-3-Oxatricyclo[3.2.1.02,4]octane
CID 11789154
Bicyclo(2.2.1)heptane, 2-methoxy-, endo-
CID 139142
cis-2,3-Epoxybicyclo[2.2.1]heptane
CID 6432296
(1R,2S,4S)-2-methoxybicyclo[2.2.1]heptane
CID 12504771
2-Butoxybicyclo(2,2,1)heptane
CID 54376525
Exo-2-(2-methylpropoxy)bicyclo[2.2.1]heptane
CID 76640935
Exo-2-(propoxy)bicyclo[2.2.1]heptane
CID 89305037
(1S,2R,3R,4R)-2-fluoro-3-(2,2,2-trifluoroethoxy)bicyclo[2.2.1]heptane
CID 10703737
2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctoxy)bicyclo[2.2.1]heptane
CID 73106667
2-(2,2,2-Trifluoroethoxy)bicyclo[2.2.1]heptane
CID 85195159
2-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecoxy)bicyclo[2.2.1]heptane
CID 102095187

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane?
The IUPAC name of 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane (CID 163761951) is 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane.
What is the SMILES notation for 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane?
The canonical SMILES for 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane is FC1(OC2CC2)CC2CCC1C2.
What is the InChIKey of 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane?
The InChIKey is LYYAIQYWUAOFIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FO/c11-10(12-9-3-4-9)6-7-1-2-8(10)5-7/h7-9H,1-6H2.
What are the key properties of 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane?
2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane has a molecular weight of 170.23 g/mol, XLogP of 2.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyloxy-2-fluorobicyclo[2.2.1]heptane is sourced from PubChem (CID 163761951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).