2-methyl-1-prop-1-en-2-ylazetidine

C7H13N — CID 147661975

IUPAC2-methyl-1-prop-1-en-2-ylazetidine
SMILESC=C(C)N1CCC1C
InChIInChI=1S/C7H13N/c1-6(2)8-5-4-7(8)3/h7H,1,4-5H2,2-3H3
InChIKeyGLNQGMLKRKSWNA-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.61
Rot. Bonds1

About 2-methyl-1-prop-1-en-2-ylazetidine

2-methyl-1-prop-1-en-2-ylazetidine (PubChem CID 147661975) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is 2-methyl-1-prop-1-en-2-ylazetidine.

Molecular Properties

Compound Name2-methyl-1-prop-1-en-2-ylazetidine
PubChem CID147661975
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name2-methyl-1-prop-1-en-2-ylazetidine
SMILESC=C(C)N1CCC1C
InChIInChI=1S/C7H13N/c1-6(2)8-5-4-7(8)3/h7H,1,4-5H2,2-3H3
InChIKeyGLNQGMLKRKSWNA-UHFFFAOYSA-N
XLogP1.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-methyl-1-prop-1-en-2-ylazetidine with MolForge

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

Launch Full Analysis

Related Compounds

3-methyl-4-prop-1-en-2-ylmorpholine
CID 145355299
2-ethyl-3-methyl-1-prop-1-en-2-ylpyrrolidine
CID 170768549
(2R)-2-methylazetidine-1-carboximidamide
CID 146189041
(2R)-1-but-1-en-2-yl-2-methylpyrrolidine
CID 134863512
2-methyl-1-[(2S)-2-methylpyrrolidin-1-yl]prop-2-en-1-one
CID 89291831
2-amino-1-(2-methylazetidin-1-yl)ethanone
CID 67101715
2,2,2-trifluoro-1-[(2R)-2-methylazetidin-1-yl]ethanone
CID 171796784
3-methyl-1-prop-1-en-2-ylpyrrolidine
CID 90249054
N-methyl-1-[(2R)-2-methylpyrrolidin-1-yl]ethenamine
CID 166869708
2-methoxy-1-(2-methylazetidin-1-yl)propan-1-one
CID 130709295
2-methyl-1-[(3E)-5-methylhexa-1,3,5-trien-3-yl]pyrrolidine
CID 144607271
2-methyl-N-prop-1-en-2-ylpiperidine-1-carboxamide
CID 108910296

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-prop-1-en-2-ylazetidine?
The IUPAC name of 2-methyl-1-prop-1-en-2-ylazetidine (CID 147661975) is 2-methyl-1-prop-1-en-2-ylazetidine.
What is the SMILES notation for 2-methyl-1-prop-1-en-2-ylazetidine?
The canonical SMILES for 2-methyl-1-prop-1-en-2-ylazetidine is C=C(C)N1CCC1C.
What is the InChIKey of 2-methyl-1-prop-1-en-2-ylazetidine?
The InChIKey is GLNQGMLKRKSWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-6(2)8-5-4-7(8)3/h7H,1,4-5H2,2-3H3.
What are the key properties of 2-methyl-1-prop-1-en-2-ylazetidine?
2-methyl-1-prop-1-en-2-ylazetidine has a molecular weight of 111.19 g/mol, XLogP of 1.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-prop-1-en-2-ylazetidine is sourced from PubChem (CID 147661975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).