(4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine

C10H18FN — CID 176919814

IUPAC(4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine
SMILESCCCC1(C)C/C(=C/F)CN1C
InChIInChI=1S/C10H18FN/c1-4-5-10(2)6-9(7-11)8-12(10)3/h7H,4-6,8H2,1-3H3/b9-7-
InChIKeyIPJJKPHPSMFIIO-CLFYSBASSA-N
MW171.26 g/mol
LogP2.73
Rot. Bonds2

About (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine

(4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine (PubChem CID 176919814) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine.

Molecular Properties

Compound Name(4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine
PubChem CID176919814
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name(4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine
SMILESCCCC1(C)C/C(=C/F)CN1C
InChIInChI=1S/C10H18FN/c1-4-5-10(2)6-9(7-11)8-12(10)3/h7H,4-6,8H2,1-3H3/b9-7-
InChIKeyIPJJKPHPSMFIIO-CLFYSBASSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine?
The IUPAC name of (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine (CID 176919814) is (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine.
What is the SMILES notation for (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine?
The canonical SMILES for (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine is CCCC1(C)C/C(=C/F)CN1C.
What is the InChIKey of (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine?
The InChIKey is IPJJKPHPSMFIIO-CLFYSBASSA-N. The full InChI is InChI=1S/C10H18FN/c1-4-5-10(2)6-9(7-11)8-12(10)3/h7H,4-6,8H2,1-3H3/b9-7-.
What are the key properties of (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine?
(4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine has a molecular weight of 171.26 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-(fluoromethylidene)-1,2-dimethyl-2-propylpyrrolidine is sourced from PubChem (CID 176919814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).