2-(2-cyclohexylethyl)-1,3,5-triazine

C11H17N3 — CID 90833787

IUPAC2-(2-cyclohexylethyl)-1,3,5-triazine
SMILESc1ncnc(CCC2CCCCC2)n1
InChIInChI=1S/C11H17N3/c1-2-4-10(5-3-1)6-7-11-13-8-12-9-14-11/h8-10H,1-7H2
InChIKeyITGNRTZRQCHBQA-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.38
Rot. Bonds3

About 2-(2-cyclohexylethyl)-1,3,5-triazine

2-(2-cyclohexylethyl)-1,3,5-triazine (PubChem CID 90833787) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-(2-cyclohexylethyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(2-cyclohexylethyl)-1,3,5-triazine
PubChem CID90833787
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-(2-cyclohexylethyl)-1,3,5-triazine
SMILESc1ncnc(CCC2CCCCC2)n1
InChIInChI=1S/C11H17N3/c1-2-4-10(5-3-1)6-7-11-13-8-12-9-14-11/h8-10H,1-7H2
InChIKeyITGNRTZRQCHBQA-UHFFFAOYSA-N
XLogP2.38
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexylethyl)-1,3,5-triazine?
The IUPAC name of 2-(2-cyclohexylethyl)-1,3,5-triazine (CID 90833787) is 2-(2-cyclohexylethyl)-1,3,5-triazine.
What is the SMILES notation for 2-(2-cyclohexylethyl)-1,3,5-triazine?
The canonical SMILES for 2-(2-cyclohexylethyl)-1,3,5-triazine is c1ncnc(CCC2CCCCC2)n1.
What is the InChIKey of 2-(2-cyclohexylethyl)-1,3,5-triazine?
The InChIKey is ITGNRTZRQCHBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-2-4-10(5-3-1)6-7-11-13-8-12-9-14-11/h8-10H,1-7H2.
What are the key properties of 2-(2-cyclohexylethyl)-1,3,5-triazine?
2-(2-cyclohexylethyl)-1,3,5-triazine has a molecular weight of 191.28 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexylethyl)-1,3,5-triazine is sourced from PubChem (CID 90833787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).