4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine

C11H19F2N — CID 130232269

IUPAC4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine
SMILESCC(C)C1CC(=C(F)F)CN1C(C)C
InChIInChI=1S/C11H19F2N/c1-7(2)10-5-9(11(12)13)6-14(10)8(3)4/h7-8,10H,5-6H2,1-4H3
InChIKeySQFZKIMDNRYOHG-UHFFFAOYSA-N
MW203.28 g/mol
LogP3.28
Rot. Bonds2

About 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine

4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine (PubChem CID 130232269) has the molecular formula C11H19F2N and a molecular weight of 203.28 g/mol. Its IUPAC name is 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine.

Molecular Properties

Compound Name4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine
PubChem CID130232269
Molecular FormulaC11H19F2N
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine
SMILESCC(C)C1CC(=C(F)F)CN1C(C)C
InChIInChI=1S/C11H19F2N/c1-7(2)10-5-9(11(12)13)6-14(10)8(3)4/h7-8,10H,5-6H2,1-4H3
InChIKeySQFZKIMDNRYOHG-UHFFFAOYSA-N
XLogP3.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(Difluoromethylidene)-1,2-dimethylpyrrolidine
CID 126641525
4-(Difluoromethylidene)-2-ethyl-1-propan-2-ylpyrrolidine
CID 130250105
(4E)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine
CID 162730758
(4Z)-4-(fluoromethylidene)-1-methyl-2-propan-2-ylpyrrolidine
CID 163514840
(4E)-4-(fluoromethylidene)-1-methyl-2-propan-2-ylpyrrolidine
CID 164062077
(4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine
CID 166984290
(2R)-4-(difluoromethylidene)-2-ethyl-1,2-dimethylpyrrolidine
CID 172288850
1-[(2S)-2-ethyl-3,4-dimethylpent-4-enyl]-3,3-difluoropyrrolidine
CID 173941052
1-Tert-butyl-4-(difluoromethylidene)-2-methylpyrrolidine
CID 174214126
(2S)-2-(fluoromethyl)-4-methylidene-1-(2-methylpropyl)pyrrolidine
CID 174855048
1-Tert-butyl-3-(difluoromethylidene)-2-methylpyrrolidine
CID 175570338
(4E)-4-(1-fluoroethylidene)-1,2-di(propan-2-yl)pyrrolidine
CID 175612304

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine?
The IUPAC name of 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine (CID 130232269) is 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine.
What is the SMILES notation for 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine?
The canonical SMILES for 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine is CC(C)C1CC(=C(F)F)CN1C(C)C.
What is the InChIKey of 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine?
The InChIKey is SQFZKIMDNRYOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F2N/c1-7(2)10-5-9(11(12)13)6-14(10)8(3)4/h7-8,10H,5-6H2,1-4H3.
What are the key properties of 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine?
4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine has a molecular weight of 203.28 g/mol, XLogP of 3.28, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine is sourced from PubChem (CID 130232269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).