N-(3-hydroxyazetidin-1-yl)propanamide

C6H12N2O2 — CID 67186139

IUPACN-(3-hydroxyazetidin-1-yl)propanamide
SMILESCCC(=O)NN1CC(O)C1
InChIInChI=1S/C6H12N2O2/c1-2-6(10)7-8-3-5(9)4-8/h5,9H,2-4H2,1H3,(H,7,10)
InChIKeyATGWBFDVWNNHCP-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.90
Rot. Bonds2

About N-(3-hydroxyazetidin-1-yl)propanamide

N-(3-hydroxyazetidin-1-yl)propanamide (PubChem CID 67186139) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is N-(3-hydroxyazetidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3-hydroxyazetidin-1-yl)propanamide
PubChem CID67186139
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC NameN-(3-hydroxyazetidin-1-yl)propanamide
SMILESCCC(=O)NN1CC(O)C1
InChIInChI=1S/C6H12N2O2/c1-2-6(10)7-8-3-5(9)4-8/h5,9H,2-4H2,1H3,(H,7,10)
InChIKeyATGWBFDVWNNHCP-UHFFFAOYSA-N
XLogP-0.90
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyazetidin-1-yl)propanamide?
The IUPAC name of N-(3-hydroxyazetidin-1-yl)propanamide (CID 67186139) is N-(3-hydroxyazetidin-1-yl)propanamide.
What is the SMILES notation for N-(3-hydroxyazetidin-1-yl)propanamide?
The canonical SMILES for N-(3-hydroxyazetidin-1-yl)propanamide is CCC(=O)NN1CC(O)C1.
What is the InChIKey of N-(3-hydroxyazetidin-1-yl)propanamide?
The InChIKey is ATGWBFDVWNNHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-2-6(10)7-8-3-5(9)4-8/h5,9H,2-4H2,1H3,(H,7,10).
What are the key properties of N-(3-hydroxyazetidin-1-yl)propanamide?
N-(3-hydroxyazetidin-1-yl)propanamide has a molecular weight of 144.17 g/mol, XLogP of -0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyazetidin-1-yl)propanamide is sourced from PubChem (CID 67186139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).