4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane

C14H25F — CID 170059975

IUPAC4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane
SMILESCC(C)C1CC(C2CCCC2F)CC1C
InChIInChI=1S/C14H25F/c1-9(2)13-8-11(7-10(13)3)12-5-4-6-14(12)15/h9-14H,4-8H2,1-3H3
InChIKeyJKFROWPHAILXFM-UHFFFAOYSA-N
MW212.35 g/mol
LogP4.44
Rot. Bonds2

About 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane

4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane (PubChem CID 170059975) has the molecular formula C14H25F and a molecular weight of 212.35 g/mol. Its IUPAC name is 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane.

Molecular Properties

Compound Name4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane
PubChem CID170059975
Molecular FormulaC14H25F
Molecular Weight212.35 g/mol
Exact Mass212.19
IUPAC Name4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane
SMILESCC(C)C1CC(C2CCCC2F)CC1C
InChIInChI=1S/C14H25F/c1-9(2)13-8-11(7-10(13)3)12-5-4-6-14(12)15/h9-14H,4-8H2,1-3H3
InChIKeyJKFROWPHAILXFM-UHFFFAOYSA-N
XLogP4.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.35
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane?
The IUPAC name of 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane (CID 170059975) is 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane.
What is the SMILES notation for 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane?
The canonical SMILES for 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane is CC(C)C1CC(C2CCCC2F)CC1C.
What is the InChIKey of 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane?
The InChIKey is JKFROWPHAILXFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F/c1-9(2)13-8-11(7-10(13)3)12-5-4-6-14(12)15/h9-14H,4-8H2,1-3H3.
What are the key properties of 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane?
4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane has a molecular weight of 212.35 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorocyclopentyl)-1-methyl-2-propan-2-ylcyclopentane is sourced from PubChem (CID 170059975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).