(3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine

C8H12FN — CID 88957760

IUPAC(3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine
SMILESC/C=C1/CNC/C1=C(/C)F
InChIInChI=1S/C8H12FN/c1-3-7-4-10-5-8(7)6(2)9/h3,10H,4-5H2,1-2H3/b7-3-,8-6+
InChIKeyZGUJBKNRVGGKKV-SYTHDNBVSA-N
MW141.19 g/mol
LogP1.78
Rot. Bonds

About (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine

(3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine (PubChem CID 88957760) has the molecular formula C8H12FN and a molecular weight of 141.19 g/mol. Its IUPAC name is (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine.

Molecular Properties

Compound Name(3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine
PubChem CID88957760
Molecular FormulaC8H12FN
Molecular Weight141.19 g/mol
Exact Mass141.10
IUPAC Name(3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine
SMILESC/C=C1/CNC/C1=C(/C)F
InChIInChI=1S/C8H12FN/c1-3-7-4-10-5-8(7)6(2)9/h3,10H,4-5H2,1-2H3/b7-3-,8-6+
InChIKeyZGUJBKNRVGGKKV-SYTHDNBVSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.19
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine?
The IUPAC name of (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine (CID 88957760) is (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine.
What is the SMILES notation for (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine?
The canonical SMILES for (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine is C/C=C1/CNC/C1=C(/C)F.
What is the InChIKey of (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine?
The InChIKey is ZGUJBKNRVGGKKV-SYTHDNBVSA-N. The full InChI is InChI=1S/C8H12FN/c1-3-7-4-10-5-8(7)6(2)9/h3,10H,4-5H2,1-2H3/b7-3-,8-6+.
What are the key properties of (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine?
(3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine has a molecular weight of 141.19 g/mol, XLogP of 1.78, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,4Z)-3-ethylidene-4-(1-fluoroethylidene)pyrrolidine is sourced from PubChem (CID 88957760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).