4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine

C13H18N6O — CID 80858888

IUPAC4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine
SMILESCC1CCCCC1Oc1nc(N)nc(-n2ccnc2)n1
InChIInChI=1S/C13H18N6O/c1-9-4-2-3-5-10(9)20-13-17-11(14)16-12(18-13)19-7-6-15-8-19/h6-10H,2-5H2,1H3,(H2,14,16,17,18)
InChIKeyQTUZIXUDRUNMKF-UHFFFAOYSA-N
MW274.33 g/mol
LogP1.60
Rot. Bonds3

About 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine

4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine (PubChem CID 80858888) has the molecular formula C13H18N6O and a molecular weight of 274.33 g/mol. Its IUPAC name is 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine
PubChem CID80858888
Molecular FormulaC13H18N6O
Molecular Weight274.33 g/mol
Exact Mass274.15
IUPAC Name4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine
SMILESCC1CCCCC1Oc1nc(N)nc(-n2ccnc2)n1
InChIInChI=1S/C13H18N6O/c1-9-4-2-3-5-10(9)20-13-17-11(14)16-12(18-13)19-7-6-15-8-19/h6-10H,2-5H2,1H3,(H2,14,16,17,18)
InChIKeyQTUZIXUDRUNMKF-UHFFFAOYSA-N
XLogP1.60
TPSA91.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine 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

[4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-yl]hydrazine
CID 80907359
4-(4,4-dimethylcyclohexyl)oxy-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 114342951
6-imidazol-1-yl-4-N-methyl-4-N-(2-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
CID 80787769
4-(2-methylcyclohexyl)oxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80845160
4-imidazol-1-yl-6-[(1-methylpiperidin-2-yl)methoxy]-1,3,5-triazin-2-amine
CID 80863288
4-imidazol-1-yl-6-(3-methylbutan-2-yloxy)-1,3,5-triazin-2-amine
CID 80883414
6-imidazol-1-yl-2-N-[(2-methylcyclopentyl)methyl]-1,3,5-triazine-2,4-diamine
CID 107421293
4-(3,4-dimethoxypyrrolidin-1-yl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 103541933
1-(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)-4-methylpiperidin-3-ol
CID 102971053
4-imidazol-1-yl-6-(oxolan-3-ylmethoxy)-1,3,5-triazin-2-amine
CID 80873031
4-imidazol-1-yl-6-(2-piperidin-1-ylethoxy)-1,3,5-triazin-2-amine
CID 80879177
2-N-(1-cyclohexylethyl)-6-imidazol-1-yl-1,3,5-triazine-2,4-diamine
CID 80801599

Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine (CID 80858888) is 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine is CC1CCCCC1Oc1nc(N)nc(-n2ccnc2)n1.
What is the InChIKey of 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine?
The InChIKey is QTUZIXUDRUNMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O/c1-9-4-2-3-5-10(9)20-13-17-11(14)16-12(18-13)19-7-6-15-8-19/h6-10H,2-5H2,1H3,(H2,14,16,17,18).
What are the key properties of 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine?
4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine has a molecular weight of 274.33 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80858888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).