1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol

C15H20FNO — CID 56854080

IUPAC1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol
SMILESOC1CCCN(CC2(c3ccc(F)cc3)CC2)C1
InChIInChI=1S/C15H20FNO/c16-13-5-3-12(4-6-13)15(7-8-15)11-17-9-1-2-14(18)10-17/h3-6,14,18H,1-2,7-11H2
InChIKeyZYFDFFFDSWMVER-UHFFFAOYSA-N
MW249.33 g/mol
LogP2.31
Rot. Bonds3

About 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol

1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol (PubChem CID 56854080) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol
PubChem CID56854080
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC Name1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol
SMILESOC1CCCN(CC2(c3ccc(F)cc3)CC2)C1
InChIInChI=1S/C15H20FNO/c16-13-5-3-12(4-6-13)15(7-8-15)11-17-9-1-2-14(18)10-17/h3-6,14,18H,1-2,7-11H2
InChIKeyZYFDFFFDSWMVER-UHFFFAOYSA-N
XLogP2.31
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol?
The IUPAC name of 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol (CID 56854080) is 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol.
What is the SMILES notation for 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol?
The canonical SMILES for 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol is OC1CCCN(CC2(c3ccc(F)cc3)CC2)C1.
What is the InChIKey of 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol?
The InChIKey is ZYFDFFFDSWMVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c16-13-5-3-12(4-6-13)15(7-8-15)11-17-9-1-2-14(18)10-17/h3-6,14,18H,1-2,7-11H2.
What are the key properties of 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol?
1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol has a molecular weight of 249.33 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(4-fluorophenyl)cyclopropyl]methyl]piperidin-3-ol is sourced from PubChem (CID 56854080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).