2-(azetidin-1-yl)ethanamine

C5H12N2 — CID 15636950

IUPAC2-(azetidin-1-yl)ethanamine
SMILESNCCN1CCC1
InChIInChI=1S/C5H12N2/c6-2-5-7-3-1-4-7/h1-6H2
InChIKeyRIHYLJLIMZMKTQ-UHFFFAOYSA-N
MW100.17 g/mol
LogP-0.35
Rot. Bonds2

About 2-(azetidin-1-yl)ethanamine

2-(azetidin-1-yl)ethanamine (PubChem CID 15636950) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is 2-(azetidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(azetidin-1-yl)ethanamine
PubChem CID15636950
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Name2-(azetidin-1-yl)ethanamine
SMILESNCCN1CCC1
InChIInChI=1S/C5H12N2/c6-2-5-7-3-1-4-7/h1-6H2
InChIKeyRIHYLJLIMZMKTQ-UHFFFAOYSA-N
XLogP-0.35
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 5-0.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)ethanamine?
The IUPAC name of 2-(azetidin-1-yl)ethanamine (CID 15636950) is 2-(azetidin-1-yl)ethanamine.
What is the SMILES notation for 2-(azetidin-1-yl)ethanamine?
The canonical SMILES for 2-(azetidin-1-yl)ethanamine is NCCN1CCC1.
What is the InChIKey of 2-(azetidin-1-yl)ethanamine?
The InChIKey is RIHYLJLIMZMKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c6-2-5-7-3-1-4-7/h1-6H2.
What are the key properties of 2-(azetidin-1-yl)ethanamine?
2-(azetidin-1-yl)ethanamine has a molecular weight of 100.17 g/mol, XLogP of -0.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)ethanamine is sourced from PubChem (CID 15636950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).