2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine

C9H16FN — CID 169130391

IUPAC2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine
SMILESC=C(F)C1(CC)CCCN1C
InChIInChI=1S/C9H16FN/c1-4-9(8(2)10)6-5-7-11(9)3/h2,4-7H2,1,3H3
InChIKeyFVQMXCUJEKCIKU-UHFFFAOYSA-N
MW157.23 g/mol
LogP2.34
Rot. Bonds2

About 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine

2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine (PubChem CID 169130391) has the molecular formula C9H16FN and a molecular weight of 157.23 g/mol. Its IUPAC name is 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine.

Molecular Properties

Compound Name2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine
PubChem CID169130391
Molecular FormulaC9H16FN
Molecular Weight157.23 g/mol
Exact Mass157.13
IUPAC Name2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine
SMILESC=C(F)C1(CC)CCCN1C
InChIInChI=1S/C9H16FN/c1-4-9(8(2)10)6-5-7-11(9)3/h2,4-7H2,1,3H3
InChIKeyFVQMXCUJEKCIKU-UHFFFAOYSA-N
XLogP2.34
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.23
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4Z)-4-(fluoromethylidene)-1-methyl-2-propan-2-ylpyrrolidine
CID 163514840
(4E)-4-(fluoromethylidene)-1-methyl-2-propan-2-ylpyrrolidine
CID 164062077
1-(2-Fluoroethyl)-2-methyl-2-prop-2-enylpyrrolidine
CID 166974420
8-Ethyl-7-fluoro-1,2,3,5-tetrahydropyrrolizine
CID 166984255
(3R)-1-[(4S)-2-ethyl-4-methylhex-5-enyl]-3-fluoropyrrolidine
CID 167009671
1-(4-Ethenyl-2-ethylhex-5-enyl)-3-fluoropyrrolidine
CID 167009907
(4Z)-2-ethyl-4-(fluoromethylidene)-1-methyl-2-propylpyrrolidine
CID 170622490
(2R)-4-(difluoromethylidene)-2-ethyl-1,2-dimethylpyrrolidine
CID 172288850
(1R)-1-ethyl-2-(2-fluoroethyl)-1,2-dimethyl-3-methylidenepyrrolidin-1-ium
CID 175614657
1-Tert-butyl-4-(difluoromethylidene)-2,2-dimethylpyrrolidine
CID 176294911
(2S,4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine
CID 176919337
4-(Difluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine
CID 176919360

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine?
The IUPAC name of 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine (CID 169130391) is 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine.
What is the SMILES notation for 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine?
The canonical SMILES for 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine is C=C(F)C1(CC)CCCN1C.
What is the InChIKey of 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine?
The InChIKey is FVQMXCUJEKCIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FN/c1-4-9(8(2)10)6-5-7-11(9)3/h2,4-7H2,1,3H3.
What are the key properties of 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine?
2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine has a molecular weight of 157.23 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(1-fluoroethenyl)-1-methylpyrrolidine is sourced from PubChem (CID 169130391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).