2-hydroxy-3-(3-methylazetidin-1-yl)propanamide

C7H14N2O2 — CID 106172308

IUPAC2-hydroxy-3-(3-methylazetidin-1-yl)propanamide
SMILESCC1CN(CC(O)C(N)=O)C1
InChIInChI=1S/C7H14N2O2/c1-5-2-9(3-5)4-6(10)7(8)11/h5-6,10H,2-4H2,1H3,(H2,8,11)
InChIKeyAGPGVJJADCFASQ-UHFFFAOYSA-N
MW158.20 g/mol
LogP-1.22
Rot. Bonds3

About 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide

2-hydroxy-3-(3-methylazetidin-1-yl)propanamide (PubChem CID 106172308) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide.

Molecular Properties

Compound Name2-hydroxy-3-(3-methylazetidin-1-yl)propanamide
PubChem CID106172308
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name2-hydroxy-3-(3-methylazetidin-1-yl)propanamide
SMILESCC1CN(CC(O)C(N)=O)C1
InChIInChI=1S/C7H14N2O2/c1-5-2-9(3-5)4-6(10)7(8)11/h5-6,10H,2-4H2,1H3,(H2,8,11)
InChIKeyAGPGVJJADCFASQ-UHFFFAOYSA-N
XLogP-1.22
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide?
The IUPAC name of 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide (CID 106172308) is 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide.
What is the SMILES notation for 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide?
The canonical SMILES for 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide is CC1CN(CC(O)C(N)=O)C1.
What is the InChIKey of 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide?
The InChIKey is AGPGVJJADCFASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-5-2-9(3-5)4-6(10)7(8)11/h5-6,10H,2-4H2,1H3,(H2,8,11).
What are the key properties of 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide?
2-hydroxy-3-(3-methylazetidin-1-yl)propanamide has a molecular weight of 158.20 g/mol, XLogP of -1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(3-methylazetidin-1-yl)propanamide is sourced from PubChem (CID 106172308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).