N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide

C6H8N6O2 — CID 21244568

IUPACN-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)NC1CNC1=O
InChIInChI=1S/C6H8N6O2/c13-5(2-12-3-8-10-11-12)9-4-1-7-6(4)14/h3-4H,1-2H2,(H,7,14)(H,9,13)
InChIKeyZEDSQBLWXCXKQW-UHFFFAOYSA-N
MW196.17 g/mol
LogP-2.71
Rot. Bonds3

About N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide

N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide (PubChem CID 21244568) has the molecular formula C6H8N6O2 and a molecular weight of 196.17 g/mol. Its IUPAC name is N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide
PubChem CID21244568
Molecular FormulaC6H8N6O2
Molecular Weight196.17 g/mol
Exact Mass196.07
IUPAC NameN-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)NC1CNC1=O
InChIInChI=1S/C6H8N6O2/c13-5(2-12-3-8-10-11-12)9-4-1-7-6(4)14/h3-4H,1-2H2,(H,7,14)(H,9,13)
InChIKeyZEDSQBLWXCXKQW-UHFFFAOYSA-N
XLogP-2.71
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.17
LogP ≤ 5-2.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide (CID 21244568) is N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide is O=C(Cn1cnnn1)NC1CNC1=O.
What is the InChIKey of N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide?
The InChIKey is ZEDSQBLWXCXKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N6O2/c13-5(2-12-3-8-10-11-12)9-4-1-7-6(4)14/h3-4H,1-2H2,(H,7,14)(H,9,13).
What are the key properties of N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide?
N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide has a molecular weight of 196.17 g/mol, XLogP of -2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxoazetidin-3-yl)-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 21244568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).