(4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine

C11H20FN — CID 170622490

IUPAC(4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine
SMILESCCCC1(CC)C/C(=C/F)CN1C
InChIInChI=1S/C11H20FN/c1-4-6-11(5-2)7-10(8-12)9-13(11)3/h8H,4-7,9H2,1-3H3/b10-8-
InChIKeyLKWQRDARQZKWEU-NTMALXAHSA-N
MW185.29 g/mol
LogP3.12
Rot. Bonds3

About (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine

(4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine (PubChem CID 170622490) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine.

Molecular Properties

Compound Name(4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine
PubChem CID170622490
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Name(4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine
SMILESCCCC1(CC)C/C(=C/F)CN1C
InChIInChI=1S/C11H20FN/c1-4-6-11(5-2)7-10(8-12)9-13(11)3/h8H,4-7,9H2,1-3H3/b10-8-
InChIKeyLKWQRDARQZKWEU-NTMALXAHSA-N
XLogP3.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Butyl-[2-fluoro-1-(3-methylidenecyclopentyl)propan-2-yl]-dimethylazanium
CID 146650902
(3R)-1-tert-butyl-3-(1,1-difluoropent-4-enyl)pyrrolidine
CID 151270858
1-(2-Fluoro-2-methylbutyl)-3-prop-1-en-2-ylpyrrolidine
CID 154974300
(4E)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine
CID 162730758
(8R)-8-ethyl-2-fluoro-6-methylidene-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 162730761
(4Z)-4-(fluoromethylidene)-1-methyl-2-propan-2-ylpyrrolidine
CID 163514840
(6E)-6-(fluoromethylidene)-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 163614751
(6E)-6-(fluoromethylidene)-8-(2-methylpropyl)-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 163977864
2-fluoro-6-methylidene-8-(2-methylpropyl)-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 163977865
(4E)-4-(fluoromethylidene)-1-methyl-2-propan-2-ylpyrrolidine
CID 164062077
(6Z,8S)-6-(fluoromethylidene)-8-methyl-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 164875903
(6E,8S)-6-(fluoromethylidene)-8-methyl-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 164875923

Frequently Asked Questions

What is the IUPAC name of (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine?
The IUPAC name of (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine (CID 170622490) is (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine.
What is the SMILES notation for (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine?
The canonical SMILES for (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine is CCCC1(CC)C/C(=C/F)CN1C.
What is the InChIKey of (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine?
The InChIKey is LKWQRDARQZKWEU-NTMALXAHSA-N. The full InChI is InChI=1S/C11H20FN/c1-4-6-11(5-2)7-10(8-12)9-13(11)3/h8H,4-7,9H2,1-3H3/b10-8-.
What are the key properties of (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine?
(4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine has a molecular weight of 185.29 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine is sourced from PubChem (CID 170622490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).