2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine

C11H16ClN3O2 — CID 62858018

IUPAC2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine
SMILESCCOc1nc(Cl)nc(OC2CCCCC2)n1
InChIInChI=1S/C11H16ClN3O2/c1-2-16-10-13-9(12)14-11(15-10)17-8-6-4-3-5-7-8/h8H,2-7H2,1H3
InChIKeyDHUYGGXZVNLTRK-UHFFFAOYSA-N
MW257.72 g/mol
LogP2.64
Rot. Bonds4

About 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine

2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine (PubChem CID 62858018) has the molecular formula C11H16ClN3O2 and a molecular weight of 257.72 g/mol. Its IUPAC name is 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine
PubChem CID62858018
Molecular FormulaC11H16ClN3O2
Molecular Weight257.72 g/mol
Exact Mass257.09
IUPAC Name2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine
SMILESCCOc1nc(Cl)nc(OC2CCCCC2)n1
InChIInChI=1S/C11H16ClN3O2/c1-2-16-10-13-9(12)14-11(15-10)17-8-6-4-3-5-7-8/h8H,2-7H2,1H3
InChIKeyDHUYGGXZVNLTRK-UHFFFAOYSA-N
XLogP2.64
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-cycloheptyloxy-6-ethoxy-N-methyl-1,3,5-triazin-2-amine
CID 80871773
4-chloro-6-cyclohexyloxy-N-methyl-1,3,5-triazin-2-amine
CID 80858811
4-chloro-6-cyclopentyloxy-N-propyl-1,3,5-triazin-2-amine
CID 80861079
4-ethoxy-6-(3-methylcyclohexyl)oxy-1,3,5-triazin-2-amine
CID 80861927
4-ethoxy-6-(3-methoxycyclohexyl)oxy-N-methyl-1,3,5-triazin-2-amine
CID 80876648
4-chloro-6-ethoxy-N-(4-methylcycloheptyl)-1,3,5-triazin-2-amine
CID 114101541
2-chloro-4-(oxolan-3-yloxy)-6-propoxy-1,3,5-triazine
CID 63557044
2-chloro-4-ethoxy-6-hexoxy-1,3,5-triazine
CID 62857023
4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine
CID 80872035
4-chloro-6-ethoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 55124366
2,4-dichloro-6-(4,4-dimethylcyclohexyl)oxy-1,3,5-triazine
CID 114340984
2-chloro-4-ethoxy-6-prop-2-enoxy-1,3,5-triazine
CID 62857200

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine?
The IUPAC name of 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine (CID 62858018) is 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine is CCOc1nc(Cl)nc(OC2CCCCC2)n1.
What is the InChIKey of 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine?
The InChIKey is DHUYGGXZVNLTRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O2/c1-2-16-10-13-9(12)14-11(15-10)17-8-6-4-3-5-7-8/h8H,2-7H2,1H3.
What are the key properties of 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine?
2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine has a molecular weight of 257.72 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-cyclohexyloxy-6-ethoxy-1,3,5-triazine is sourced from PubChem (CID 62858018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).