4-(1-fluoro-2-methoxyethylidene)piperidine

C8H14FNO — CID 178069082

IUPAC4-(1-fluoro-2-methoxyethylidene)piperidine
SMILESCOCC(F)=C1CCNCC1
InChIInChI=1S/C8H14FNO/c1-11-6-8(9)7-2-4-10-5-3-7/h10H,2-6H2,1H3
InChIKeyNJNXDTWZNJRTJH-UHFFFAOYSA-N
MW159.20 g/mol
LogP1.24
Rot. Bonds2

About 4-(1-fluoro-2-methoxyethylidene)piperidine

4-(1-fluoro-2-methoxyethylidene)piperidine (PubChem CID 178069082) has the molecular formula C8H14FNO and a molecular weight of 159.20 g/mol. Its IUPAC name is 4-(1-fluoro-2-methoxyethylidene)piperidine.

Molecular Properties

Compound Name4-(1-fluoro-2-methoxyethylidene)piperidine
PubChem CID178069082
Molecular FormulaC8H14FNO
Molecular Weight159.20 g/mol
Exact Mass159.11
IUPAC Name4-(1-fluoro-2-methoxyethylidene)piperidine
SMILESCOCC(F)=C1CCNCC1
InChIInChI=1S/C8H14FNO/c1-11-6-8(9)7-2-4-10-5-3-7/h10H,2-6H2,1H3
InChIKeyNJNXDTWZNJRTJH-UHFFFAOYSA-N
XLogP1.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.20
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1-fluoro-2-methoxyethylidene)piperidine?
The IUPAC name of 4-(1-fluoro-2-methoxyethylidene)piperidine (CID 178069082) is 4-(1-fluoro-2-methoxyethylidene)piperidine.
What is the SMILES notation for 4-(1-fluoro-2-methoxyethylidene)piperidine?
The canonical SMILES for 4-(1-fluoro-2-methoxyethylidene)piperidine is COCC(F)=C1CCNCC1.
What is the InChIKey of 4-(1-fluoro-2-methoxyethylidene)piperidine?
The InChIKey is NJNXDTWZNJRTJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO/c1-11-6-8(9)7-2-4-10-5-3-7/h10H,2-6H2,1H3.
What are the key properties of 4-(1-fluoro-2-methoxyethylidene)piperidine?
4-(1-fluoro-2-methoxyethylidene)piperidine has a molecular weight of 159.20 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-fluoro-2-methoxyethylidene)piperidine is sourced from PubChem (CID 178069082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).