4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one

C17H17N5O3 — CID 154765396

IUPAC4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCC1CN(C(=O)c2cnc3c(c2)NC(=O)CN3C)c2cccnc2O1
InChIInChI=1S/C17H17N5O3/c1-10-8-22(13-4-3-5-18-16(13)25-10)17(24)11-6-12-15(19-7-11)21(2)9-14(23)20-12/h3-7,10H,8-9H2,1-2H3,(H,20,23)
InChIKeyDCGSWQPHGFOIHU-UHFFFAOYSA-N
MW339.36 g/mol
LogP1.29
Rot. Bonds1

About 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one

4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one (PubChem CID 154765396) has the molecular formula C17H17N5O3 and a molecular weight of 339.36 g/mol. Its IUPAC name is 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one.

Molecular Properties

Compound Name4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one
PubChem CID154765396
Molecular FormulaC17H17N5O3
Molecular Weight339.36 g/mol
Exact Mass339.13
IUPAC Name4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCC1CN(C(=O)c2cnc3c(c2)NC(=O)CN3C)c2cccnc2O1
InChIInChI=1S/C17H17N5O3/c1-10-8-22(13-4-3-5-18-16(13)25-10)17(24)11-6-12-15(19-7-11)21(2)9-14(23)20-12/h3-7,10H,8-9H2,1-2H3,(H,20,23)
InChIKeyDCGSWQPHGFOIHU-UHFFFAOYSA-N
XLogP1.29
TPSA87.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.36
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The IUPAC name of 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one (CID 154765396) is 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one.
What is the SMILES notation for 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The canonical SMILES for 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one is CC1CN(C(=O)c2cnc3c(c2)NC(=O)CN3C)c2cccnc2O1.
What is the InChIKey of 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The InChIKey is DCGSWQPHGFOIHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O3/c1-10-8-22(13-4-3-5-18-16(13)25-10)17(24)11-6-12-15(19-7-11)21(2)9-14(23)20-12/h3-7,10H,8-9H2,1-2H3,(H,20,23).
What are the key properties of 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one has a molecular weight of 339.36 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-7-(3-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)-1,3-dihydropyrido[2,3-b]pyrazin-2-one is sourced from PubChem (CID 154765396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).