1-(azetidin-3-yl)-N-methylmethanamine

C5H12N2 — CID 14280898

IUPAC1-(azetidin-3-yl)-N-methylmethanamine
SMILESCNCC1CNC1
InChIInChI=1S/C5H12N2/c1-6-2-5-3-7-4-5/h5-7H,2-4H2,1H3
InChIKeyRUZHGFVEMQGCAW-UHFFFAOYSA-N
MW100.17 g/mol
LogP-0.57
Rot. Bonds2

About 1-(azetidin-3-yl)-N-methylmethanamine

1-(azetidin-3-yl)-N-methylmethanamine (PubChem CID 14280898) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(azetidin-3-yl)-N-methylmethanamine
PubChem CID14280898
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Name1-(azetidin-3-yl)-N-methylmethanamine
SMILESCNCC1CNC1
InChIInChI=1S/C5H12N2/c1-6-2-5-3-7-4-5/h5-7H,2-4H2,1H3
InChIKeyRUZHGFVEMQGCAW-UHFFFAOYSA-N
XLogP-0.57
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(azetidin-3-yl)-N-methylmethanamine (CID 14280898) is 1-(azetidin-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(azetidin-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(azetidin-3-yl)-N-methylmethanamine is CNCC1CNC1.
What is the InChIKey of 1-(azetidin-3-yl)-N-methylmethanamine?
The InChIKey is RUZHGFVEMQGCAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-6-2-5-3-7-4-5/h5-7H,2-4H2,1H3.
What are the key properties of 1-(azetidin-3-yl)-N-methylmethanamine?
1-(azetidin-3-yl)-N-methylmethanamine has a molecular weight of 100.17 g/mol, XLogP of -0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-N-methylmethanamine is sourced from PubChem (CID 14280898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).