2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine

C11H15Cl2N3 — CID 20828209

IUPAC2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine
SMILESClc1nc(Cl)nc(CCC2CCCCC2)n1
InChIInChI=1S/C11H15Cl2N3/c12-10-14-9(15-11(13)16-10)7-6-8-4-2-1-3-5-8/h8H,1-7H2
InChIKeyGVVINWFDYACHJK-UHFFFAOYSA-N
MW260.17 g/mol
LogP3.69
Rot. Bonds3

About 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine

2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine (PubChem CID 20828209) has the molecular formula C11H15Cl2N3 and a molecular weight of 260.17 g/mol. Its IUPAC name is 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine
PubChem CID20828209
Molecular FormulaC11H15Cl2N3
Molecular Weight260.17 g/mol
Exact Mass259.06
IUPAC Name2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine
SMILESClc1nc(Cl)nc(CCC2CCCCC2)n1
InChIInChI=1S/C11H15Cl2N3/c12-10-14-9(15-11(13)16-10)7-6-8-4-2-1-3-5-8/h8H,1-7H2
InChIKeyGVVINWFDYACHJK-UHFFFAOYSA-N
XLogP3.69
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.17
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine (CID 20828209) is 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine is Clc1nc(Cl)nc(CCC2CCCCC2)n1.
What is the InChIKey of 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine?
The InChIKey is GVVINWFDYACHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Cl2N3/c12-10-14-9(15-11(13)16-10)7-6-8-4-2-1-3-5-8/h8H,1-7H2.
What are the key properties of 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine?
2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine has a molecular weight of 260.17 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(2-cyclohexylethyl)-1,3,5-triazine is sourced from PubChem (CID 20828209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).