2-methyl-5-(trifluoromethyl)pyrrolidine

C6H10F3N — CID 15672704

IUPAC2-methyl-5-(trifluoromethyl)pyrrolidine
SMILESCC1CCC(C(F)(F)F)N1
InChIInChI=1S/C6H10F3N/c1-4-2-3-5(10-4)6(7,8)9/h4-5,10H,2-3H2,1H3
InChIKeyLYZMQCBYCLBDBH-UHFFFAOYSA-N
MW153.15 g/mol
LogP1.69
Rot. Bonds

About 2-methyl-5-(trifluoromethyl)pyrrolidine

2-methyl-5-(trifluoromethyl)pyrrolidine (PubChem CID 15672704) has the molecular formula C6H10F3N and a molecular weight of 153.15 g/mol. Its IUPAC name is 2-methyl-5-(trifluoromethyl)pyrrolidine.

Molecular Properties

Compound Name2-methyl-5-(trifluoromethyl)pyrrolidine
PubChem CID15672704
Molecular FormulaC6H10F3N
Molecular Weight153.15 g/mol
Exact Mass153.08
IUPAC Name2-methyl-5-(trifluoromethyl)pyrrolidine
SMILESCC1CCC(C(F)(F)F)N1
InChIInChI=1S/C6H10F3N/c1-4-2-3-5(10-4)6(7,8)9/h4-5,10H,2-3H2,1H3
InChIKeyLYZMQCBYCLBDBH-UHFFFAOYSA-N
XLogP1.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.15
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(trifluoromethyl)pyrrolidine?
The IUPAC name of 2-methyl-5-(trifluoromethyl)pyrrolidine (CID 15672704) is 2-methyl-5-(trifluoromethyl)pyrrolidine.
What is the SMILES notation for 2-methyl-5-(trifluoromethyl)pyrrolidine?
The canonical SMILES for 2-methyl-5-(trifluoromethyl)pyrrolidine is CC1CCC(C(F)(F)F)N1.
What is the InChIKey of 2-methyl-5-(trifluoromethyl)pyrrolidine?
The InChIKey is LYZMQCBYCLBDBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3N/c1-4-2-3-5(10-4)6(7,8)9/h4-5,10H,2-3H2,1H3.
What are the key properties of 2-methyl-5-(trifluoromethyl)pyrrolidine?
2-methyl-5-(trifluoromethyl)pyrrolidine has a molecular weight of 153.15 g/mol, XLogP of 1.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(trifluoromethyl)pyrrolidine is sourced from PubChem (CID 15672704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).