4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine

C14H24FNO — CID 176712282

IUPAC4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
SMILESCC(C)OCC1(CN2CCC(=CF)CC2)CC1
InChIInChI=1S/C14H24FNO/c1-12(2)17-11-14(5-6-14)10-16-7-3-13(9-15)4-8-16/h9,12H,3-8,10-11H2,1-2H3
InChIKeyPSASVLCAKPYGOW-UHFFFAOYSA-N
MW241.35 g/mol
LogP3.14
Rot. Bonds5

About 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine

4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine (PubChem CID 176712282) has the molecular formula C14H24FNO and a molecular weight of 241.35 g/mol. Its IUPAC name is 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine.

Molecular Properties

Compound Name4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
PubChem CID176712282
Molecular FormulaC14H24FNO
Molecular Weight241.35 g/mol
Exact Mass241.18
IUPAC Name4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
SMILESCC(C)OCC1(CN2CCC(=CF)CC2)CC1
InChIInChI=1S/C14H24FNO/c1-12(2)17-11-14(5-6-14)10-16-7-3-13(9-15)4-8-16/h9,12H,3-8,10-11H2,1-2H3
InChIKeyPSASVLCAKPYGOW-UHFFFAOYSA-N
XLogP3.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.35
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Fluoro-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 170412689
(3S)-3-fluoro-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 170421855
(3R)-3-fluoro-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 170421856
3-Fluoro-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 172205572
4-Ethenyl-4-fluoro-1-[[1-(prop-1-en-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 172350532
(4E)-4-(fluoromethylidene)-1,3-dimethyl-3-(propan-2-yloxymethyl)piperidine
CID 176568100
4-(Difluoromethylidene)-1-[[1-(methoxymethyl)cyclopropyl]methyl]piperidine
CID 176663502
4-(Difluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine
CID 176663644
(1S)-1-[1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]ethanol
CID 176663801
4-(Difluoromethylidene)-1-[[1-(ethoxymethyl)cyclopropyl]methyl]piperidine
CID 176664215
(3S,4E)-1-ethyl-4-(fluoromethylidene)-3-methyl-3-(propan-2-yloxymethyl)piperidine
CID 177009152
1-[[2,2-difluoro-1-(propan-2-yloxymethyl)cyclopropyl]methyl]-4-[(E)-2-fluoroethenyl]piperidine
CID 177009548

Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine?
The IUPAC name of 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine (CID 176712282) is 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine.
What is the SMILES notation for 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine?
The canonical SMILES for 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine is CC(C)OCC1(CN2CCC(=CF)CC2)CC1.
What is the InChIKey of 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine?
The InChIKey is PSASVLCAKPYGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24FNO/c1-12(2)17-11-14(5-6-14)10-16-7-3-13(9-15)4-8-16/h9,12H,3-8,10-11H2,1-2H3.
What are the key properties of 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine?
4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine has a molecular weight of 241.35 g/mol, XLogP of 3.14, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethylidene)-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]piperidine is sourced from PubChem (CID 176712282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).