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

C14H9Cl2N3 — CID 71361703

IUPAC2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine
SMILESCc1ccc(-c2nc(Cl)nc(Cl)n2)c2ccccc12
InChIInChI=1S/C14H9Cl2N3/c1-8-6-7-11(10-5-3-2-4-9(8)10)12-17-13(15)19-14(16)18-12/h2-7H,1H3
InChIKeyZJZXATLGVRSOHX-UHFFFAOYSA-N
MW290.15 g/mol
LogP4.31
Rot. Bonds1

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

2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine (PubChem CID 71361703) has the molecular formula C14H9Cl2N3 and a molecular weight of 290.15 g/mol. Its IUPAC name is 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine
PubChem CID71361703
Molecular FormulaC14H9Cl2N3
Molecular Weight290.15 g/mol
Exact Mass289.02
IUPAC Name2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine
SMILESCc1ccc(-c2nc(Cl)nc(Cl)n2)c2ccccc12
InChIInChI=1S/C14H9Cl2N3/c1-8-6-7-11(10-5-3-2-4-9(8)10)12-17-13(15)19-14(16)18-12/h2-7H,1H3
InChIKeyZJZXATLGVRSOHX-UHFFFAOYSA-N
XLogP4.31
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.15
LogP ≤ 54.31
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-(4-methylnaphthalen-1-yl)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine (CID 71361703) is 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine is Cc1ccc(-c2nc(Cl)nc(Cl)n2)c2ccccc12.
What is the InChIKey of 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine?
The InChIKey is ZJZXATLGVRSOHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2N3/c1-8-6-7-11(10-5-3-2-4-9(8)10)12-17-13(15)19-14(16)18-12/h2-7H,1H3.
What are the key properties of 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine?
2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine has a molecular weight of 290.15 g/mol, XLogP of 4.31, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(4-methylnaphthalen-1-yl)-1,3,5-triazine is sourced from PubChem (CID 71361703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).