6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione

C11H18N4O3 — CID 62359067

IUPAC6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCn1nc(NC2CCCCC2O)c(=O)n(C)c1=O
InChIInChI=1S/C11H18N4O3/c1-14-10(17)9(13-15(2)11(14)18)12-7-5-3-4-6-8(7)16/h7-8,16H,3-6H2,1-2H3,(H,12,13)
InChIKeyQXOZUHCSJUOPBS-UHFFFAOYSA-N
MW254.29 g/mol
LogP-0.81
Rot. Bonds2

About 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione

6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione (PubChem CID 62359067) has the molecular formula C11H18N4O3 and a molecular weight of 254.29 g/mol. Its IUPAC name is 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione.

Molecular Properties

Compound Name6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
PubChem CID62359067
Molecular FormulaC11H18N4O3
Molecular Weight254.29 g/mol
Exact Mass254.14
IUPAC Name6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCn1nc(NC2CCCCC2O)c(=O)n(C)c1=O
InChIInChI=1S/C11H18N4O3/c1-14-10(17)9(13-15(2)11(14)18)12-7-5-3-4-6-8(7)16/h7-8,16H,3-6H2,1-2H3,(H,12,13)
InChIKeyQXOZUHCSJUOPBS-UHFFFAOYSA-N
XLogP-0.81
TPSA89.15 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-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

6-(1-Hydroxybutan-2-ylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 43410468
6-[(4-Hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 43410482
6-[(4-hydroxycyclohexyl)amino]-2H-1,2,4-triazine-3,5-dione
CID 43410687
2,4-Dimethyl-6-(oxan-2-ylmethylamino)-1,2,4-triazine-3,5-dione
CID 55014478
6-[2-(Hydroxymethyl)piperidin-1-yl]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 60658547
6-[(1-Hydroxy-4-methylpentan-2-yl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 61246006
6-[Cyclohexyl(2-hydroxyethyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 61583708
6-[(2-hydroxycyclohexyl)amino]-2H-1,2,4-triazine-3,5-dione
CID 62359068
6-[[1-(Hydroxymethyl)cyclohexyl]amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 62520259
6-[(2-Cyclopropyl-2-hydroxyethyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 63239548
6-[2-(4-Aminocyclohexyl)oxyethylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 63871525
6-[(2-Amino-3-hydroxybutyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 64539396

Frequently Asked Questions

What is the IUPAC name of 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The IUPAC name of 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione (CID 62359067) is 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione.
What is the SMILES notation for 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The canonical SMILES for 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione is Cn1nc(NC2CCCCC2O)c(=O)n(C)c1=O.
What is the InChIKey of 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The InChIKey is QXOZUHCSJUOPBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3/c1-14-10(17)9(13-15(2)11(14)18)12-7-5-3-4-6-8(7)16/h7-8,16H,3-6H2,1-2H3,(H,12,13).
What are the key properties of 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione has a molecular weight of 254.29 g/mol, XLogP of -0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-hydroxycyclohexyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione is sourced from PubChem (CID 62359067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).