2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine

C11H20F3NO — CID 130399588

IUPAC2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine
SMILESCOCC1(CC(F)(F)F)CCCN1C(C)C
InChIInChI=1S/C11H20F3NO/c1-9(2)15-6-4-5-10(15,8-16-3)7-11(12,13)14/h9H,4-8H2,1-3H3
InChIKeyJKUIHWZMEZKJRN-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.83
Rot. Bonds4

About 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine

2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine (PubChem CID 130399588) has the molecular formula C11H20F3NO and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine.

Molecular Properties

Compound Name2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine
PubChem CID130399588
Molecular FormulaC11H20F3NO
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC Name2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine
SMILESCOCC1(CC(F)(F)F)CCCN1C(C)C
InChIInChI=1S/C11H20F3NO/c1-9(2)15-6-4-5-10(15,8-16-3)7-11(12,13)14/h9H,4-8H2,1-3H3
InChIKeyJKUIHWZMEZKJRN-UHFFFAOYSA-N
XLogP2.83
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine?
The IUPAC name of 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine (CID 130399588) is 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine.
What is the SMILES notation for 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine?
The canonical SMILES for 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine is COCC1(CC(F)(F)F)CCCN1C(C)C.
What is the InChIKey of 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine?
The InChIKey is JKUIHWZMEZKJRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO/c1-9(2)15-6-4-5-10(15,8-16-3)7-11(12,13)14/h9H,4-8H2,1-3H3.
What are the key properties of 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine?
2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine has a molecular weight of 239.28 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-1-propan-2-yl-2-(2,2,2-trifluoroethyl)pyrrolidine is sourced from PubChem (CID 130399588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).