2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide

C9H14N4O2 — CID 64610377

IUPAC2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
SMILESCc1noc(CNC(=O)CC2CNC2)n1
InChIInChI=1S/C9H14N4O2/c1-6-12-9(15-13-6)5-11-8(14)2-7-3-10-4-7/h7,10H,2-5H2,1H3,(H,11,14)
InChIKeyMFOOPHTVDPPSSB-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.40
Rot. Bonds4

About 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide

2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide (PubChem CID 64610377) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
PubChem CID64610377
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
SMILESCc1noc(CNC(=O)CC2CNC2)n1
InChIInChI=1S/C9H14N4O2/c1-6-12-9(15-13-6)5-11-8(14)2-7-3-10-4-7/h7,10H,2-5H2,1H3,(H,11,14)
InChIKeyMFOOPHTVDPPSSB-UHFFFAOYSA-N
XLogP-0.40
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide (CID 64610377) is 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide is Cc1noc(CNC(=O)CC2CNC2)n1.
What is the InChIKey of 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
The InChIKey is MFOOPHTVDPPSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-6-12-9(15-13-6)5-11-8(14)2-7-3-10-4-7/h7,10H,2-5H2,1H3,(H,11,14).
What are the key properties of 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide?
2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide has a molecular weight of 210.24 g/mol, XLogP of -0.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide is sourced from PubChem (CID 64610377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).