2-[azetidin-3-yl(methyl)amino]ethanol

C6H14N2O — CID 21027193

IUPAC2-[azetidin-3-yl(methyl)amino]ethanol
SMILESCN(CCO)C1CNC1
InChIInChI=1S/C6H14N2O/c1-8(2-3-9)6-4-7-5-6/h6-7,9H,2-5H2,1H3
InChIKeyKVGSBNWWWIMPMT-UHFFFAOYSA-N
MW130.19 g/mol
LogP-1.12
Rot. Bonds3

About 2-[azetidin-3-yl(methyl)amino]ethanol

2-[azetidin-3-yl(methyl)amino]ethanol (PubChem CID 21027193) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is 2-[azetidin-3-yl(methyl)amino]ethanol.

Molecular Properties

Compound Name2-[azetidin-3-yl(methyl)amino]ethanol
PubChem CID21027193
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name2-[azetidin-3-yl(methyl)amino]ethanol
SMILESCN(CCO)C1CNC1
InChIInChI=1S/C6H14N2O/c1-8(2-3-9)6-4-7-5-6/h6-7,9H,2-5H2,1H3
InChIKeyKVGSBNWWWIMPMT-UHFFFAOYSA-N
XLogP-1.12
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-1.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[azetidin-3-yl(methyl)amino]ethanol?
The IUPAC name of 2-[azetidin-3-yl(methyl)amino]ethanol (CID 21027193) is 2-[azetidin-3-yl(methyl)amino]ethanol.
What is the SMILES notation for 2-[azetidin-3-yl(methyl)amino]ethanol?
The canonical SMILES for 2-[azetidin-3-yl(methyl)amino]ethanol is CN(CCO)C1CNC1.
What is the InChIKey of 2-[azetidin-3-yl(methyl)amino]ethanol?
The InChIKey is KVGSBNWWWIMPMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-8(2-3-9)6-4-7-5-6/h6-7,9H,2-5H2,1H3.
What are the key properties of 2-[azetidin-3-yl(methyl)amino]ethanol?
2-[azetidin-3-yl(methyl)amino]ethanol has a molecular weight of 130.19 g/mol, XLogP of -1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[azetidin-3-yl(methyl)amino]ethanol is sourced from PubChem (CID 21027193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).