3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide

C8H15N3O3 — CID 106175935

IUPAC3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide
SMILESNC(=O)C(O)CNC(=O)CC1CNC1
InChIInChI=1S/C8H15N3O3/c9-8(14)6(12)4-11-7(13)1-5-2-10-3-5/h5-6,10,12H,1-4H2,(H2,9,14)(H,11,13)
InChIKeyIGLNLYRPWFASHU-UHFFFAOYSA-N
MW201.23 g/mol
LogP-2.44
Rot. Bonds5

About 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide

3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide (PubChem CID 106175935) has the molecular formula C8H15N3O3 and a molecular weight of 201.23 g/mol. Its IUPAC name is 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide
PubChem CID106175935
Molecular FormulaC8H15N3O3
Molecular Weight201.23 g/mol
Exact Mass201.11
IUPAC Name3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide
SMILESNC(=O)C(O)CNC(=O)CC1CNC1
InChIInChI=1S/C8H15N3O3/c9-8(14)6(12)4-11-7(13)1-5-2-10-3-5/h5-6,10,12H,1-4H2,(H2,9,14)(H,11,13)
InChIKeyIGLNLYRPWFASHU-UHFFFAOYSA-N
XLogP-2.44
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 5-2.44
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide?
The IUPAC name of 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide (CID 106175935) is 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide?
The canonical SMILES for 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide is NC(=O)C(O)CNC(=O)CC1CNC1.
What is the InChIKey of 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide?
The InChIKey is IGLNLYRPWFASHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O3/c9-8(14)6(12)4-11-7(13)1-5-2-10-3-5/h5-6,10,12H,1-4H2,(H2,9,14)(H,11,13).
What are the key properties of 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide?
3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide has a molecular weight of 201.23 g/mol, XLogP of -2.44, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(azetidin-3-yl)acetyl]amino]-2-hydroxypropanamide is sourced from PubChem (CID 106175935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).