2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine

C10H16F3N — CID 176800860

IUPAC2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
SMILESCC(C)C12CC(F)CN1CC(F)(F)C2
InChIInChI=1S/C10H16F3N/c1-7(2)9-3-8(11)4-14(9)6-10(12,13)5-9/h7-8H,3-6H2,1-2H3
InChIKeyPOIPPVXFLHKCFA-UHFFFAOYSA-N
MW207.24 g/mol
LogP2.46
Rot. Bonds1

About 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine

2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine (PubChem CID 176800860) has the molecular formula C10H16F3N and a molecular weight of 207.24 g/mol. Its IUPAC name is 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine.

Molecular Properties

Compound Name2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
PubChem CID176800860
Molecular FormulaC10H16F3N
Molecular Weight207.24 g/mol
Exact Mass207.12
IUPAC Name2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
SMILESCC(C)C12CC(F)CN1CC(F)(F)C2
InChIInChI=1S/C10H16F3N/c1-7(2)9-3-8(11)4-14(9)6-10(12,13)5-9/h7-8H,3-6H2,1-2H3
InChIKeyPOIPPVXFLHKCFA-UHFFFAOYSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.24
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
The IUPAC name of 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine (CID 176800860) is 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine.
What is the SMILES notation for 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
The canonical SMILES for 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine is CC(C)C12CC(F)CN1CC(F)(F)C2.
What is the InChIKey of 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
The InChIKey is POIPPVXFLHKCFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N/c1-7(2)9-3-8(11)4-14(9)6-10(12,13)5-9/h7-8H,3-6H2,1-2H3.
What are the key properties of 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine has a molecular weight of 207.24 g/mol, XLogP of 2.46, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,6-trifluoro-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine is sourced from PubChem (CID 176800860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).