(2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine

C10H18FN — CID 178101519

IUPAC(2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine
SMILESCC(C)C[C@@H]1C/C(=C/F)CN1C
InChIInChI=1S/C10H18FN/c1-8(2)4-10-5-9(6-11)7-12(10)3/h6,8,10H,4-5,7H2,1-3H3/b9-6-/t10-/m1/s1
InChIKeySMFFNCLQRPYSAI-ABRRARGCSA-N
MW171.26 g/mol
LogP2.59
Rot. Bonds2

About (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine

(2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine (PubChem CID 178101519) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine.

Molecular Properties

Compound Name(2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine
PubChem CID178101519
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name(2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine
SMILESCC(C)C[C@@H]1C/C(=C/F)CN1C
InChIInChI=1S/C10H18FN/c1-8(2)4-10-5-9(6-11)7-12(10)3/h6,8,10H,4-5,7H2,1-3H3/b9-6-/t10-/m1/s1
InChIKeySMFFNCLQRPYSAI-ABRRARGCSA-N
XLogP2.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-Isopropyl-2-methyl-2,3-butadienyl)pyrrolidine
CID 337533
(2S,4S)-4-fluoro-2-(3-methylbut-1-en-2-yl)pyrrolidine
CID 89494790
4-Fluoro-4-methyl-2-(3-methylbut-1-en-2-yl)pyrrolidine
CID 91554489
4-Fluoro-2-(3-methylpent-1-en-2-yl)pyrrolidine
CID 123254453
4-(Difluoromethylidene)-1,2-di(propan-2-yl)pyrrolidine
CID 130232269
2-[2-(Fluoromethyl)prop-2-enyl]-1-(5-methylhex-1-en-2-yl)pyrrolidine
CID 155418263
(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
(2R,4S)-4-fluoro-1-methyl-2-prop-1-en-2-ylpyrrolidine
CID 166928477
(4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine
CID 166984290
(4E)-2-ethyl-4-(fluoromethylidene)-1-methylpyrrolidine
CID 169130389

Frequently Asked Questions

What is the IUPAC name of (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine?
The IUPAC name of (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine (CID 178101519) is (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine.
What is the SMILES notation for (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine?
The canonical SMILES for (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine is CC(C)C[C@@H]1C/C(=C/F)CN1C.
What is the InChIKey of (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine?
The InChIKey is SMFFNCLQRPYSAI-ABRRARGCSA-N. The full InChI is InChI=1S/C10H18FN/c1-8(2)4-10-5-9(6-11)7-12(10)3/h6,8,10H,4-5,7H2,1-3H3/b9-6-/t10-/m1/s1.
What are the key properties of (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine?
(2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine has a molecular weight of 171.26 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4Z)-4-(fluoromethylidene)-1-methyl-2-(2-methylpropyl)pyrrolidine is sourced from PubChem (CID 178101519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).