2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine

C13H13N3O2 — CID 86053148

IUPAC2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine
SMILESCOc1nc(C=Cc2ccccc2)nc(OC)n1
InChIInChI=1S/C13H13N3O2/c1-17-12-14-11(15-13(16-12)18-2)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKeyAJYRPKFQKTXSHS-UHFFFAOYSA-N
MW243.27 g/mol
LogP2.06
Rot. Bonds4

About 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine

2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine (PubChem CID 86053148) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine
PubChem CID86053148
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine
SMILESCOc1nc(C=Cc2ccccc2)nc(OC)n1
InChIInChI=1S/C13H13N3O2/c1-17-12-14-11(15-13(16-12)18-2)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKeyAJYRPKFQKTXSHS-UHFFFAOYSA-N
XLogP2.06
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[2-[4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]phenyl]ethenyl]phenyl]-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 70617138
4-chloro-6,7-dimethoxy-2-[(E)-2-phenylethenyl]quinazoline
CID 139921672
1-methoxy-4-(4-phenylbuta-1,3-dienyl)benzene
CID 4560156
CID 70567885
CID 70567885
CID 70569152
CID 70569152
N,N-dimethylmethanamine;stilbene
CID 174368184
sodium 2-N-[4-[2-[4-[(4-anilino-6-methoxy-1,3,5-triazin-2-yl)amino]-2-oxidoperoxysulfanylphenyl]ethenyl]phenyl]-6-methoxy-4-N-phenyl-1,3,5-triazine-2,4-diamine
CID 59668393
tris(4-methoxyphenoxy)-[(E)-2-phenylethenyl]silane
CID 102056330
hydride;rubidium(1+);stilbene
CID 173437843
disodium;hydride;(E)-stilbene
CID 173089328
5-chloro-3-[(E)-2-phenylethenyl]-1,2,4-thiadiazole
CID 67697151
4-[(E)-2-[4,6-bis[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-1,3,5-triazin-2-yl]ethenyl]-N,N-diphenylaniline
CID 102184385

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine?
The IUPAC name of 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine (CID 86053148) is 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine?
The canonical SMILES for 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine is COc1nc(C=Cc2ccccc2)nc(OC)n1.
What is the InChIKey of 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine?
The InChIKey is AJYRPKFQKTXSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-17-12-14-11(15-13(16-12)18-2)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3.
What are the key properties of 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine?
2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine has a molecular weight of 243.27 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-6-(2-phenylethenyl)-1,3,5-triazine is sourced from PubChem (CID 86053148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).