5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine

C13H21N3O — CID 80858978

IUPAC5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine
SMILESCCc1c(N)ncnc1OC1CCCCC1C
InChIInChI=1S/C13H21N3O/c1-3-10-12(14)15-8-16-13(10)17-11-7-5-4-6-9(11)2/h8-9,11H,3-7H2,1-2H3,(H2,14,15,16)
InChIKeyXWYGWUSAQBUHDT-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.58
Rot. Bonds3

About 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine

5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine (PubChem CID 80858978) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine
PubChem CID80858978
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine
SMILESCCc1c(N)ncnc1OC1CCCCC1C
InChIInChI=1S/C13H21N3O/c1-3-10-12(14)15-8-16-13(10)17-11-7-5-4-6-9(11)2/h8-9,11H,3-7H2,1-2H3,(H2,14,15,16)
InChIKeyXWYGWUSAQBUHDT-UHFFFAOYSA-N
XLogP2.58
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-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

5-ethyl-2-[(1S,2R)-2-methylcyclohexyl]oxypyrimidine
CID 162165542
(6-cyclohexyloxy-5-ethylpyrimidin-4-yl)hydrazine
CID 80910051
6-methyl-2-(2-methylcyclohexyl)oxypyridin-3-amine
CID 81131536
4-N-cyclobutyl-5-ethylpyrimidine-4,6-diamine
CID 80827503
2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol
CID 80810039
N-ethyl-5-methyl-4-(2-methylcyclohexyl)oxypyrimidin-2-amine
CID 80859417
4-N-(2,3-dimethylcyclopentyl)-5-ethylpyrimidine-4,6-diamine
CID 80840241
5-ethyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80797287
6-but-3-enoxy-5-ethylpyrimidin-4-amine
CID 80862301
4-N-cyclopentyl-5-ethyl-4-N-(3-methylbutyl)pyrimidine-4,6-diamine
CID 80854897
9-[3-(2-methylcyclohexyl)oxypropyl]purin-6-amine
CID 66424922
5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide
CID 114408551

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine (CID 80858978) is 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine is CCc1c(N)ncnc1OC1CCCCC1C.
What is the InChIKey of 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine?
The InChIKey is XWYGWUSAQBUHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-10-12(14)15-8-16-13(10)17-11-7-5-4-6-9(11)2/h8-9,11H,3-7H2,1-2H3,(H2,14,15,16).
What are the key properties of 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine?
5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-(2-methylcyclohexyl)oxypyrimidin-4-amine is sourced from PubChem (CID 80858978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).