2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one

C9H8N2O2 — CID 102348256

IUPAC2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one
SMILESCc1cnc2nc(C)oc(=O)c2c1
InChIInChI=1S/C9H8N2O2/c1-5-3-7-8(10-4-5)11-6(2)13-9(7)12/h3-4H,1-2H3
InChIKeyMIAMITZDEOYFJQ-UHFFFAOYSA-N
MW176.17 g/mol
LogP1.20
Rot. Bonds

About 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one

2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one (PubChem CID 102348256) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one.

Molecular Properties

Compound Name2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one
PubChem CID102348256
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one
SMILESCc1cnc2nc(C)oc(=O)c2c1
InChIInChI=1S/C9H8N2O2/c1-5-3-7-8(10-4-5)11-6(2)13-9(7)12/h3-4H,1-2H3
InChIKeyMIAMITZDEOYFJQ-UHFFFAOYSA-N
XLogP1.20
TPSA55.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one with MolForge

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

Launch Full Analysis

Related Compounds

Methyl Nicotinate
CID 7151
Ethyl Nicotinate
CID 69188
2-Butoxyethyl 3-pyridinecarboxylate
CID 14866
Hexyl nicotinate
CID 90202
2-Aminonicotinic acid
CID 72930
Isopropyl nicotinate
CID 68379
Butyl nicotinate
CID 81353
Nicametate
CID 71650
Methyl 6-aminonicotinate
CID 737487
6-Aminonicotinic acid
CID 18496
Octyl nicotinate
CID 96462
Nicotinic acid, pentyl ester
CID 348507

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one?
The IUPAC name of 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one (CID 102348256) is 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one.
What is the SMILES notation for 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one?
The canonical SMILES for 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one is Cc1cnc2nc(C)oc(=O)c2c1.
What is the InChIKey of 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one?
The InChIKey is MIAMITZDEOYFJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c1-5-3-7-8(10-4-5)11-6(2)13-9(7)12/h3-4H,1-2H3.
What are the key properties of 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one?
2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one has a molecular weight of 176.17 g/mol, XLogP of 1.20, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylpyrido[2,3-d][1,3]oxazin-4-one is sourced from PubChem (CID 102348256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).