2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine

C19H23N3 — CID 154388626

IUPAC2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine
SMILESCC1C=CC=CC1(C)c1ncnc(C2(C)C=CC=CC2C)n1
InChIInChI=1S/C19H23N3/c1-14-9-5-7-11-18(14,3)16-20-13-21-17(22-16)19(4)12-8-6-10-15(19)2/h5-15H,1-4H3
InChIKeyQUGARBUWMZNRER-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.91
Rot. Bonds2

About 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine

2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine (PubChem CID 154388626) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine
PubChem CID154388626
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC Name2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine
SMILESCC1C=CC=CC1(C)c1ncnc(C2(C)C=CC=CC2C)n1
InChIInChI=1S/C19H23N3/c1-14-9-5-7-11-18(14,3)16-20-13-21-17(22-16)19(4)12-8-6-10-15(19)2/h5-15H,1-4H3
InChIKeyQUGARBUWMZNRER-UHFFFAOYSA-N
XLogP3.91
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Cyclohexa-2,4-dien-1-yl-1,3,5-triazine
CID 22336442
2-Cyclohexa-1,5-dien-1-yl-4-cyclohexa-2,4-dien-1-yl-1,3,5-triazine
CID 129200532
2,4-Di(cyclohexa-2,4-dien-1-yl)-6-methyl-1,3,5-triazine
CID 130312830
2-(1,4-Dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine
CID 140971764
2-(1,6-Dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine
CID 141155390
2-(2,8-dimethylspiro[2.5]octa-4,6-dien-2-yl)-4-[(3Z,5Z)-2-methylocta-3,5,7-trien-2-yl]-1,3,5-triazine
CID 142355524
2,4-bis[(3E,5Z)-hepta-1,3,5-trien-4-yl]-1,3,5-triazine;ethane
CID 144983703
2-Cyclohexa-1,5-dien-1-yl-4-(2-methylcyclopenta-2,4-dien-1-yl)-1,3,5-triazine
CID 154955725
2-(4-Methylcyclohexa-1,5-dien-1-yl)-4-(4-methylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine
CID 156225701
2-[(3E,5Z)-hepta-1,3,5-trien-4-yl]-4-[(2E,4Z)-hexa-2,4-dien-3-yl]-1,3,5-triazine
CID 166761284
2,4-bis[(2E,4Z)-hepta-2,4,6-trien-3-yl]-1,3,5-triazine
CID 166761286
2-[(6S)-1-bicyclo[4.1.0]hepta-2,4-dienyl]-1,3,5-triazine
CID 167122054

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine?
The IUPAC name of 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine (CID 154388626) is 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine.
What is the SMILES notation for 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine?
The canonical SMILES for 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine is CC1C=CC=CC1(C)c1ncnc(C2(C)C=CC=CC2C)n1.
What is the InChIKey of 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine?
The InChIKey is QUGARBUWMZNRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3/c1-14-9-5-7-11-18(14,3)16-20-13-21-17(22-16)19(4)12-8-6-10-15(19)2/h5-15H,1-4H3.
What are the key properties of 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine?
2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine has a molecular weight of 293.41 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(1,6-dimethylcyclohexa-2,4-dien-1-yl)-1,3,5-triazine is sourced from PubChem (CID 154388626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).