2-[azetidin-3-yl(ethyl)amino]acetic acid

C7H14N2O2 — CID 66184731

IUPAC2-[azetidin-3-yl(ethyl)amino]acetic acid
SMILESCCN(CC(=O)O)C1CNC1
InChIInChI=1S/C7H14N2O2/c1-2-9(5-7(10)11)6-3-8-4-6/h6,8H,2-5H2,1H3,(H,10,11)
InChIKeyIFGAUXBJMOHOFY-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.64
Rot. Bonds4

About 2-[azetidin-3-yl(ethyl)amino]acetic acid

2-[azetidin-3-yl(ethyl)amino]acetic acid (PubChem CID 66184731) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-[azetidin-3-yl(ethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[azetidin-3-yl(ethyl)amino]acetic acid
PubChem CID66184731
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name2-[azetidin-3-yl(ethyl)amino]acetic acid
SMILESCCN(CC(=O)O)C1CNC1
InChIInChI=1S/C7H14N2O2/c1-2-9(5-7(10)11)6-3-8-4-6/h6,8H,2-5H2,1H3,(H,10,11)
InChIKeyIFGAUXBJMOHOFY-UHFFFAOYSA-N
XLogP-0.64
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[azetidin-3-yl(ethyl)amino]-N,N-diethylacetamide
CID 66182586
2-[azetidin-3-yl(ethyl)amino]-N,N-dimethylacetamide
CID 62786505
2-[azetidin-3-yl(methyl)amino]acetic acid;dihydrochloride
CID 146154016
2-[azetidin-3-yl(ethyl)amino]-N-benzyl-N-methylacetamide
CID 66181525
2-[ethyl-(5-methylpiperidin-3-yl)amino]acetamide
CID 103102723
2-[(3,3-dimethylcyclopentyl)-ethylamino]acetic acid
CID 80698921
2-[cyclopropyl-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]amino]acetic acid
CID 54945400
2-[azetidin-3-yl(ethyl)amino]-N-(2-methylcyclohexyl)acetamide
CID 66182805
1-[2-[azetidin-3-yl(ethyl)amino]acetyl]pyrrolidin-2-one
CID 66184308
2-[azetidin-3-yl(ethyl)amino]-N-(4-bromophenyl)acetamide
CID 66183425
2-[azetidin-3-yl(ethyl)amino]-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 66182806
2-[azetidin-3-yl(ethyl)amino]-N-(3,5-difluorophenyl)acetamide
CID 66184313

Frequently Asked Questions

What is the IUPAC name of 2-[azetidin-3-yl(ethyl)amino]acetic acid?
The IUPAC name of 2-[azetidin-3-yl(ethyl)amino]acetic acid (CID 66184731) is 2-[azetidin-3-yl(ethyl)amino]acetic acid.
What is the SMILES notation for 2-[azetidin-3-yl(ethyl)amino]acetic acid?
The canonical SMILES for 2-[azetidin-3-yl(ethyl)amino]acetic acid is CCN(CC(=O)O)C1CNC1.
What is the InChIKey of 2-[azetidin-3-yl(ethyl)amino]acetic acid?
The InChIKey is IFGAUXBJMOHOFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-2-9(5-7(10)11)6-3-8-4-6/h6,8H,2-5H2,1H3,(H,10,11).
What are the key properties of 2-[azetidin-3-yl(ethyl)amino]acetic acid?
2-[azetidin-3-yl(ethyl)amino]acetic acid has a molecular weight of 158.20 g/mol, XLogP of -0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[azetidin-3-yl(ethyl)amino]acetic acid is sourced from PubChem (CID 66184731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).