(4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine

C8H14FN — CID 177054028

IUPAC(4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine
SMILESC/C(F)=C1/CC(C)N(C)C1
InChIInChI=1S/C8H14FN/c1-6-4-8(7(2)9)5-10(6)3/h6H,4-5H2,1-3H3/b8-7+
InChIKeyGERKAJWZPAJWBE-BQYQJAHWSA-N
MW143.21 g/mol
LogP1.95
Rot. Bonds

About (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine

(4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine (PubChem CID 177054028) has the molecular formula C8H14FN and a molecular weight of 143.21 g/mol. Its IUPAC name is (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine.

Molecular Properties

Compound Name(4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine
PubChem CID177054028
Molecular FormulaC8H14FN
Molecular Weight143.21 g/mol
Exact Mass143.11
IUPAC Name(4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine
SMILESC/C(F)=C1/CC(C)N(C)C1
InChIInChI=1S/C8H14FN/c1-6-4-8(7(2)9)5-10(6)3/h6H,4-5H2,1-3H3/b8-7+
InChIKeyGERKAJWZPAJWBE-BQYQJAHWSA-N
XLogP1.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Ethyl-2-(4-fluoropenta-2,4-dien-2-yl)pyrrolidine
CID 123887890
4-(Difluoromethylidene)-1,2-dimethylpyrrolidine
CID 126641525
2,2-difluoro-7-methyl-3,5,6,8a-tetrahydro-1H-indolizine
CID 142154439
(2S)-1-[(E)-2-ethylbut-2-enyl]-2-(fluoromethyl)pyrrolidine
CID 144607829
(2R)-2-[(3E)-4-fluoropenta-1,3-dien-2-yl]-1-methylpyrrolidine
CID 146476929
(4S)-4-fluoro-1-methyl-2-[(E)-prop-1-enyl]pyrrolidine
CID 164921927
3-fluoro-1-[(2E)-2-(2-methylpropylidene)cyclopentyl]pyrrolidine
CID 164922204
4-fluoro-1-methyl-2-[(E)-4-methylpent-2-en-2-yl]pyrrolidine
CID 164922213
4-fluoro-1-methyl-2-[(E)-prop-1-enyl]pyrrolidine
CID 164922214
1-(2-fluoroethyl)-2-[(E)-3-methylbut-1-enyl]pyrrolidine
CID 164922377
4-fluoro-1-methyl-2-[(E)-3-methylbut-1-enyl]pyrrolidine
CID 164922390
(4R)-4-fluoro-1-methyl-2-[(E)-3-methylbut-1-enyl]pyrrolidine
CID 164922818

Frequently Asked Questions

What is the IUPAC name of (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine?
The IUPAC name of (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine (CID 177054028) is (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine.
What is the SMILES notation for (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine?
The canonical SMILES for (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine is C/C(F)=C1/CC(C)N(C)C1.
What is the InChIKey of (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine?
The InChIKey is GERKAJWZPAJWBE-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H14FN/c1-6-4-8(7(2)9)5-10(6)3/h6H,4-5H2,1-3H3/b8-7+.
What are the key properties of (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine?
(4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine has a molecular weight of 143.21 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-4-(1-fluoroethylidene)-1,2-dimethylpyrrolidine is sourced from PubChem (CID 177054028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).