(6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine

C8H12FN — CID 170224469

IUPAC(6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine
SMILESF/C=C1/CC2CCCN2C1
InChIInChI=1S/C8H12FN/c9-5-7-4-8-2-1-3-10(8)6-7/h5,8H,1-4,6H2/b7-5-
InChIKeyMTRCGDYROZIYTJ-ALCCZGGFSA-N
MW141.19 g/mol
LogP1.71
Rot. Bonds

About (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine

(6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine (PubChem CID 170224469) has the molecular formula C8H12FN and a molecular weight of 141.19 g/mol. Its IUPAC name is (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine.

Molecular Properties

Compound Name(6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine
PubChem CID170224469
Molecular FormulaC8H12FN
Molecular Weight141.19 g/mol
Exact Mass141.10
IUPAC Name(6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine
SMILESF/C=C1/CC2CCCN2C1
InChIInChI=1S/C8H12FN/c9-5-7-4-8-2-1-3-10(8)6-7/h5,8H,1-4,6H2/b7-5-
InChIKeyMTRCGDYROZIYTJ-ALCCZGGFSA-N
XLogP1.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.19
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine?
The IUPAC name of (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine (CID 170224469) is (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine.
What is the SMILES notation for (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine?
The canonical SMILES for (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine is F/C=C1/CC2CCCN2C1.
What is the InChIKey of (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine?
The InChIKey is MTRCGDYROZIYTJ-ALCCZGGFSA-N. The full InChI is InChI=1S/C8H12FN/c9-5-7-4-8-2-1-3-10(8)6-7/h5,8H,1-4,6H2/b7-5-.
What are the key properties of (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine?
(6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine has a molecular weight of 141.19 g/mol, XLogP of 1.71, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-6-(fluoromethylidene)-1,2,3,5,7,8-hexahydropyrrolizine is sourced from PubChem (CID 170224469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).