1-methylazetidin-3-amine

C4H10N2 — CID 18712662

IUPAC1-methylazetidin-3-amine
SMILESCN1CC(N)C1
InChIInChI=1S/C4H10N2/c1-6-2-4(5)3-6/h4H,2-3,5H2,1H3
InChIKeyBIWZYRJXBPPLLA-UHFFFAOYSA-N
MW86.14 g/mol
LogP-0.74
Rot. Bonds

About 1-methylazetidin-3-amine

1-methylazetidin-3-amine (PubChem CID 18712662) has the molecular formula C4H10N2 and a molecular weight of 86.14 g/mol. Its IUPAC name is 1-methylazetidin-3-amine.

Molecular Properties

Compound Name1-methylazetidin-3-amine
PubChem CID18712662
Molecular FormulaC4H10N2
Molecular Weight86.14 g/mol
Exact Mass86.08
IUPAC Name1-methylazetidin-3-amine
SMILESCN1CC(N)C1
InChIInChI=1S/C4H10N2/c1-6-2-4(5)3-6/h4H,2-3,5H2,1H3
InChIKeyBIWZYRJXBPPLLA-UHFFFAOYSA-N
XLogP-0.74
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.14
LogP ≤ 5-0.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methylazetidin-3-amine?
The IUPAC name of 1-methylazetidin-3-amine (CID 18712662) is 1-methylazetidin-3-amine.
What is the SMILES notation for 1-methylazetidin-3-amine?
The canonical SMILES for 1-methylazetidin-3-amine is CN1CC(N)C1.
What is the InChIKey of 1-methylazetidin-3-amine?
The InChIKey is BIWZYRJXBPPLLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2/c1-6-2-4(5)3-6/h4H,2-3,5H2,1H3.
What are the key properties of 1-methylazetidin-3-amine?
1-methylazetidin-3-amine has a molecular weight of 86.14 g/mol, XLogP of -0.74, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylazetidin-3-amine is sourced from PubChem (CID 18712662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).