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

C11H20FN — CID 163619299

IUPAC6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
SMILESCC(C)C12CCCN1CC(C)(F)C2
InChIInChI=1S/C11H20FN/c1-9(2)11-5-4-6-13(11)8-10(3,12)7-11/h9H,4-8H2,1-3H3
InChIKeyAAOLWFPUWZEPLN-UHFFFAOYSA-N
MW185.29 g/mol
LogP2.61
Rot. Bonds1

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

6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine (PubChem CID 163619299) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine.

Molecular Properties

Compound Name6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
PubChem CID163619299
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Name6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine
SMILESCC(C)C12CCCN1CC(C)(F)C2
InChIInChI=1S/C11H20FN/c1-9(2)11-5-4-6-13(11)8-10(3,12)7-11/h9H,4-8H2,1-3H3
InChIKeyAAOLWFPUWZEPLN-UHFFFAOYSA-N
XLogP2.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-fluoro-6-methyl-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 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
The IUPAC name of 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine (CID 163619299) is 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine.
What is the SMILES notation for 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
The canonical SMILES for 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine is CC(C)C12CCCN1CC(C)(F)C2.
What is the InChIKey of 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
The InChIKey is AAOLWFPUWZEPLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FN/c1-9(2)11-5-4-6-13(11)8-10(3,12)7-11/h9H,4-8H2,1-3H3.
What are the key properties of 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine?
6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine has a molecular weight of 185.29 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-6-methyl-8-propan-2-yl-2,3,5,7-tetrahydro-1H-pyrrolizine is sourced from PubChem (CID 163619299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).