3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

C7H8N2O — CID 13196538

IUPAC3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESc1cnc2c(c1)OCCN2
InChIInChI=1S/C7H8N2O/c1-2-6-7(8-3-1)9-4-5-10-6/h1-3H,4-5H2,(H,8,9)
InChIKeyQQVXDMFULJVZLA-UHFFFAOYSA-N
MW136.15 g/mol
LogP0.89
Rot. Bonds

About 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (PubChem CID 13196538) has the molecular formula C7H8N2O and a molecular weight of 136.15 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.

Molecular Properties

Compound Name3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
PubChem CID13196538
Molecular FormulaC7H8N2O
Molecular Weight136.15 g/mol
Exact Mass136.06
IUPAC Name3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESc1cnc2c(c1)OCCN2
InChIInChI=1S/C7H8N2O/c1-2-6-7(8-3-1)9-4-5-10-6/h1-3H,4-5H2,(H,8,9)
InChIKeyQQVXDMFULJVZLA-UHFFFAOYSA-N
XLogP0.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The IUPAC name of 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (CID 13196538) is 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.
What is the SMILES notation for 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The canonical SMILES for 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is c1cnc2c(c1)OCCN2.
What is the InChIKey of 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The InChIKey is QQVXDMFULJVZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O/c1-2-6-7(8-3-1)9-4-5-10-6/h1-3H,4-5H2,(H,8,9).
What are the key properties of 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine has a molecular weight of 136.15 g/mol, XLogP of 0.89, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is sourced from PubChem (CID 13196538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).