2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione

C11H15N3O3 — CID 130310690

IUPAC2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
SMILESCCN1C(=O)c2c(O)c(=O)c(C)cn2CN1C
InChIInChI=1S/C11H15N3O3/c1-4-14-11(17)8-10(16)9(15)7(2)5-13(8)6-12(14)3/h5,16H,4,6H2,1-3H3
InChIKeySEYYNCRFKLSIMP-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.14
Rot. Bonds1

About 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione

2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione (PubChem CID 130310690) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione.

Molecular Properties

Compound Name2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
PubChem CID130310690
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
SMILESCCN1C(=O)c2c(O)c(=O)c(C)cn2CN1C
InChIInChI=1S/C11H15N3O3/c1-4-14-11(17)8-10(16)9(15)7(2)5-13(8)6-12(14)3/h5,16H,4,6H2,1-3H3
InChIKeySEYYNCRFKLSIMP-UHFFFAOYSA-N
XLogP0.14
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione 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

1-ethyl-5-hydroxy-7-methyl-3-[(2R)-1,1,1-trifluoropropan-2-yl]-2H-pyrido[2,1-f][1,2,4]triazine-4,6-dione
CID 130310688
7,9-dihydroxy-2,3-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
CID 130255051
2-ethyl-7,9-dihydroxy-3-methyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
CID 130255477
2,3-diethyl-7,9-dihydroxy-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
CID 130255863
5-hydroxy-3-(2-methoxyethyl)-1,7-dimethyl-2H-pyrido[2,1-f][1,2,4]triazine-4,6-dione
CID 130310659
11-Hydroxy-13-methyl-1,3,8-triazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-9,12-dione
CID 130310661
5-hydroxy-3-(2-methoxyethyl)-7-methyl-1-(2-methylpropyl)-2H-pyrido[2,1-f][1,2,4]triazine-4,6-dione
CID 130310662
2,3-diethyl-9-hydroxy-7-methyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
CID 130310663
9-hydroxy-3-(2-methoxyethyl)-7-methyl-2-propan-2-yl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
CID 130310664
10-Hydroxy-12-methyl-1,3,7-triazatricyclo[7.4.0.03,7]trideca-9,12-diene-8,11-dione
CID 130310665
10-Hydroxy-6,12-dimethyl-1,3,7-triazatricyclo[7.4.0.03,7]trideca-9,12-diene-8,11-dione
CID 130310666
9-hydroxy-2,3-bis(2-methoxyethyl)-7-methyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione
CID 130310669

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione?
The IUPAC name of 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione (CID 130310690) is 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione.
What is the SMILES notation for 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione?
The canonical SMILES for 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione is CCN1C(=O)c2c(O)c(=O)c(C)cn2CN1C.
What is the InChIKey of 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione?
The InChIKey is SEYYNCRFKLSIMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-4-14-11(17)8-10(16)9(15)7(2)5-13(8)6-12(14)3/h5,16H,4,6H2,1-3H3.
What are the key properties of 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione?
2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione has a molecular weight of 237.26 g/mol, XLogP of 0.14, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-9-hydroxy-3,7-dimethyl-4H-pyrido[1,2-d][1,2,4]triazine-1,8-dione is sourced from PubChem (CID 130310690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).