4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine

C12H20N4O2 — CID 80858256

IUPAC4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine
SMILESCCC1CCCCC1Oc1nc(N)nc(OC)n1
InChIInChI=1S/C12H20N4O2/c1-3-8-6-4-5-7-9(8)18-12-15-10(13)14-11(16-12)17-2/h8-9H,3-7H2,1-2H3,(H2,13,14,15,16)
InChIKeyAPFYJMRUTMSOAY-UHFFFAOYSA-N
MW252.32 g/mol
LogP1.81
Rot. Bonds4

About 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine

4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine (PubChem CID 80858256) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine
PubChem CID80858256
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine
SMILESCCC1CCCCC1Oc1nc(N)nc(OC)n1
InChIInChI=1S/C12H20N4O2/c1-3-8-6-4-5-7-9(8)18-12-15-10(13)14-11(16-12)17-2/h8-9H,3-7H2,1-2H3,(H2,13,14,15,16)
InChIKeyAPFYJMRUTMSOAY-UHFFFAOYSA-N
XLogP1.81
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(2-ethylcyclohexyl)oxy-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566214
[2-(4,6-dimethoxypyrimidin-2-yl)oxycyclohexyl]methanamine
CID 115355544
4-(2-ethylcyclohexyl)oxy-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80844713
2-bromo-6-(2-ethylcyclohexyl)oxypyridine
CID 63964037
2-chloro-4-(2-ethylcyclohexyl)oxy-6-pyrrolidin-1-yl-1,3,5-triazine
CID 62869087
2-(chloromethyl)-6-(2-ethylcyclohexyl)oxypyridine
CID 63446435
2-bromo-5-(2-ethylcyclohexyl)oxy-1,3,4-thiadiazole
CID 64622389
5-(chloromethyl)-2-(2-ethylcyclohexyl)oxy-4-methylpyrimidine
CID 83183729
[4-(2-ethylcyclohexyl)oxypyrimidin-2-yl]hydrazine
CID 80909980
2-(2-ethylcyclohexyl)oxy-3,4-difluoroaniline
CID 62533930
[2-[(5,6-diethyl-1,2,4-triazin-3-yl)oxy]cyclohexyl]methanamine
CID 105363297
3-bromo-5-(2-ethylcyclohexyl)oxyaniline
CID 103588346

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine (CID 80858256) is 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine is CCC1CCCCC1Oc1nc(N)nc(OC)n1.
What is the InChIKey of 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine?
The InChIKey is APFYJMRUTMSOAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-3-8-6-4-5-7-9(8)18-12-15-10(13)14-11(16-12)17-2/h8-9H,3-7H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine?
4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine has a molecular weight of 252.32 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80858256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).