2,3,3-trimethylpyrrolidine

C7H15N — CID 59188792

IUPAC2,3,3-trimethylpyrrolidine
SMILESCC1NCCC1(C)C
InChIInChI=1S/C7H15N/c1-6-7(2,3)4-5-8-6/h6,8H,4-5H2,1-3H3
InChIKeySGVPYTKLHWHYIC-UHFFFAOYSA-N
MW113.20 g/mol
LogP1.39
Rot. Bonds

About 2,3,3-trimethylpyrrolidine

2,3,3-trimethylpyrrolidine (PubChem CID 59188792) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is 2,3,3-trimethylpyrrolidine.

Molecular Properties

Compound Name2,3,3-trimethylpyrrolidine
PubChem CID59188792
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name2,3,3-trimethylpyrrolidine
SMILESCC1NCCC1(C)C
InChIInChI=1S/C7H15N/c1-6-7(2,3)4-5-8-6/h6,8H,4-5H2,1-3H3
InChIKeySGVPYTKLHWHYIC-UHFFFAOYSA-N
XLogP1.39
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3,3-trimethylpyrrolidine 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 2,3,3-trimethylpyrrolidine?
The IUPAC name of 2,3,3-trimethylpyrrolidine (CID 59188792) is 2,3,3-trimethylpyrrolidine.
What is the SMILES notation for 2,3,3-trimethylpyrrolidine?
The canonical SMILES for 2,3,3-trimethylpyrrolidine is CC1NCCC1(C)C.
What is the InChIKey of 2,3,3-trimethylpyrrolidine?
The InChIKey is SGVPYTKLHWHYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N/c1-6-7(2,3)4-5-8-6/h6,8H,4-5H2,1-3H3.
What are the key properties of 2,3,3-trimethylpyrrolidine?
2,3,3-trimethylpyrrolidine has a molecular weight of 113.20 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trimethylpyrrolidine is sourced from PubChem (CID 59188792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).