2-fluoro-2-piperidin-4-ylideneethanamine

C7H13FN2 — CID 142778208

IUPAC2-fluoro-2-piperidin-4-ylideneethanamine
SMILESNCC(F)=C1CCNCC1
InChIInChI=1S/C7H13FN2/c8-7(5-9)6-1-3-10-4-2-6/h10H,1-5,9H2
InChIKeyVMXDLLFPNACBMZ-UHFFFAOYSA-N
MW144.19 g/mol
LogP0.55
Rot. Bonds1

About 2-fluoro-2-piperidin-4-ylideneethanamine

2-fluoro-2-piperidin-4-ylideneethanamine (PubChem CID 142778208) has the molecular formula C7H13FN2 and a molecular weight of 144.19 g/mol. Its IUPAC name is 2-fluoro-2-piperidin-4-ylideneethanamine.

Molecular Properties

Compound Name2-fluoro-2-piperidin-4-ylideneethanamine
PubChem CID142778208
Molecular FormulaC7H13FN2
Molecular Weight144.19 g/mol
Exact Mass144.11
IUPAC Name2-fluoro-2-piperidin-4-ylideneethanamine
SMILESNCC(F)=C1CCNCC1
InChIInChI=1S/C7H13FN2/c8-7(5-9)6-1-3-10-4-2-6/h10H,1-5,9H2
InChIKeyVMXDLLFPNACBMZ-UHFFFAOYSA-N
XLogP0.55
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-piperidin-4-ylideneethanamine?
The IUPAC name of 2-fluoro-2-piperidin-4-ylideneethanamine (CID 142778208) is 2-fluoro-2-piperidin-4-ylideneethanamine.
What is the SMILES notation for 2-fluoro-2-piperidin-4-ylideneethanamine?
The canonical SMILES for 2-fluoro-2-piperidin-4-ylideneethanamine is NCC(F)=C1CCNCC1.
What is the InChIKey of 2-fluoro-2-piperidin-4-ylideneethanamine?
The InChIKey is VMXDLLFPNACBMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13FN2/c8-7(5-9)6-1-3-10-4-2-6/h10H,1-5,9H2.
What are the key properties of 2-fluoro-2-piperidin-4-ylideneethanamine?
2-fluoro-2-piperidin-4-ylideneethanamine has a molecular weight of 144.19 g/mol, XLogP of 0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-piperidin-4-ylideneethanamine is sourced from PubChem (CID 142778208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).