3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone

C10H13N3O2 — CID 25072614

IUPAC3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone
SMILESCc1oncc1C(=O)N1CC2CNCC21
InChIInChI=1S/C10H13N3O2/c1-6-8(3-12-15-6)10(14)13-5-7-2-11-4-9(7)13/h3,7,9,11H,2,4-5H2,1H3
InChIKeyCSLHBXVFJQETTC-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.03
Rot. Bonds1

About 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone

3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone (PubChem CID 25072614) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone.

Molecular Properties

Compound Name3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone
PubChem CID25072614
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone
SMILESCc1oncc1C(=O)N1CC2CNCC21
InChIInChI=1S/C10H13N3O2/c1-6-8(3-12-15-6)10(14)13-5-7-2-11-4-9(7)13/h3,7,9,11H,2,4-5H2,1H3
InChIKeyCSLHBXVFJQETTC-UHFFFAOYSA-N
XLogP0.03
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone?
The IUPAC name of 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone (CID 25072614) is 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone.
What is the SMILES notation for 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone?
The canonical SMILES for 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone is Cc1oncc1C(=O)N1CC2CNCC21.
What is the InChIKey of 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone?
The InChIKey is CSLHBXVFJQETTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-6-8(3-12-15-6)10(14)13-5-7-2-11-4-9(7)13/h3,7,9,11H,2,4-5H2,1H3.
What are the key properties of 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone?
3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone has a molecular weight of 207.23 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-diazabicyclo[3.2.0]heptan-6-yl-(5-methyl-1,2-oxazol-4-yl)methanone is sourced from PubChem (CID 25072614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).