1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine

C9H12N2O — CID 150405091

IUPAC1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine
SMILESCC1CN(C)c2cccnc2O1
InChIInChI=1S/C9H12N2O/c1-7-6-11(2)8-4-3-5-10-9(8)12-7/h3-5,7H,6H2,1-2H3
InChIKeyHEOUULGCGVFFPY-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.30
Rot. Bonds

About 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine

1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine (PubChem CID 150405091) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine.

Molecular Properties

Compound Name1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine
PubChem CID150405091
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine
SMILESCC1CN(C)c2cccnc2O1
InChIInChI=1S/C9H12N2O/c1-7-6-11(2)8-4-3-5-10-9(8)12-7/h3-5,7H,6H2,1-2H3
InChIKeyHEOUULGCGVFFPY-UHFFFAOYSA-N
XLogP1.30
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine?
The IUPAC name of 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine (CID 150405091) is 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine.
What is the SMILES notation for 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine?
The canonical SMILES for 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine is CC1CN(C)c2cccnc2O1.
What is the InChIKey of 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine?
The InChIKey is HEOUULGCGVFFPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-7-6-11(2)8-4-3-5-10-9(8)12-7/h3-5,7H,6H2,1-2H3.
What are the key properties of 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine?
1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine has a molecular weight of 164.21 g/mol, XLogP of 1.30, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2,3-dihydropyrido[2,3-b][1,4]oxazine is sourced from PubChem (CID 150405091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).