4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine

C11H20FNO — CID 169255737

IUPAC4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine
SMILESCOCC1(CN2CCC(F)CC2)CC1
InChIInChI=1S/C11H20FNO/c1-14-9-11(4-5-11)8-13-6-2-10(12)3-7-13/h10H,2-9H2,1H3
InChIKeyKJGYNCKFQLNNTM-UHFFFAOYSA-N
MW201.28 g/mol
LogP1.85
Rot. Bonds4

About 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine

4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine (PubChem CID 169255737) has the molecular formula C11H20FNO and a molecular weight of 201.28 g/mol. Its IUPAC name is 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine.

Molecular Properties

Compound Name4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine
PubChem CID169255737
Molecular FormulaC11H20FNO
Molecular Weight201.28 g/mol
Exact Mass201.15
IUPAC Name4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine
SMILESCOCC1(CN2CCC(F)CC2)CC1
InChIInChI=1S/C11H20FNO/c1-14-9-11(4-5-11)8-13-6-2-10(12)3-7-13/h10H,2-9H2,1H3
InChIKeyKJGYNCKFQLNNTM-UHFFFAOYSA-N
XLogP1.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.28
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine?
The IUPAC name of 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine (CID 169255737) is 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine.
What is the SMILES notation for 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine?
The canonical SMILES for 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine is COCC1(CN2CCC(F)CC2)CC1.
What is the InChIKey of 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine?
The InChIKey is KJGYNCKFQLNNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FNO/c1-14-9-11(4-5-11)8-13-6-2-10(12)3-7-13/h10H,2-9H2,1H3.
What are the key properties of 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine?
4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine has a molecular weight of 201.28 g/mol, XLogP of 1.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine is sourced from PubChem (CID 169255737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).