4,4-diphenyl-1H-1,3,5-triazine

C15H13N3 — CID 151250872

IUPAC4,4-diphenyl-1H-1,3,5-triazine
SMILESC1=NC(c2ccccc2)(c2ccccc2)N=CN1
InChIInChI=1S/C15H13N3/c1-3-7-13(8-4-1)15(17-11-16-12-18-15)14-9-5-2-6-10-14/h1-12H,(H,16,17,18)
InChIKeyNSHLNCQIMMRKGT-UHFFFAOYSA-N
MW235.29 g/mol
LogP2.55
Rot. Bonds2

About 4,4-diphenyl-1H-1,3,5-triazine

4,4-diphenyl-1H-1,3,5-triazine (PubChem CID 151250872) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is 4,4-diphenyl-1H-1,3,5-triazine.

Molecular Properties

Compound Name4,4-diphenyl-1H-1,3,5-triazine
PubChem CID151250872
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name4,4-diphenyl-1H-1,3,5-triazine
SMILESC1=NC(c2ccccc2)(c2ccccc2)N=CN1
InChIInChI=1S/C15H13N3/c1-3-7-13(8-4-1)15(17-11-16-12-18-15)14-9-5-2-6-10-14/h1-12H,(H,16,17,18)
InChIKeyNSHLNCQIMMRKGT-UHFFFAOYSA-N
XLogP2.55
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 69215720
5,5-diphenyl-1,4-dihydroimidazole
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2-[3,5-bis(2-phenylbenzimidazol-2-yl)phenyl]-2-phenylbenzimidazole
CID 23146814
1,2,3,4,5,6,7,8,9,10-decakis-phenylhexacyclo[4.4.0.02,5.03,9.04,8.07,10]decane
CID 132561908
(1,3,3-triphenylcyclobutyl)benzene
CID 101271353
5,5-diphenyl-1,2-oxazolidine
CID 10823076
2,5,5-triphenyl-1,4-dihydroimidazole
CID 22054806
4-phenyl-1,4-dihydro-1,3,5-triazine
CID 10678525
trimethyl-[(2S)-2-phenyloxiran-2-yl]silane
CID 135037115
trimethyl-(1-phenylcyclopropyl)silane
CID 5314804
(2R)-1,2-dimethyl-2-phenylaziridine
CID 102030003
4,4,5-triphenyl-5-(trifluoromethyl)-1H-imidazole
CID 173192380

Frequently Asked Questions

What is the IUPAC name of 4,4-diphenyl-1H-1,3,5-triazine?
The IUPAC name of 4,4-diphenyl-1H-1,3,5-triazine (CID 151250872) is 4,4-diphenyl-1H-1,3,5-triazine.
What is the SMILES notation for 4,4-diphenyl-1H-1,3,5-triazine?
The canonical SMILES for 4,4-diphenyl-1H-1,3,5-triazine is C1=NC(c2ccccc2)(c2ccccc2)N=CN1.
What is the InChIKey of 4,4-diphenyl-1H-1,3,5-triazine?
The InChIKey is NSHLNCQIMMRKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c1-3-7-13(8-4-1)15(17-11-16-12-18-15)14-9-5-2-6-10-14/h1-12H,(H,16,17,18).
What are the key properties of 4,4-diphenyl-1H-1,3,5-triazine?
4,4-diphenyl-1H-1,3,5-triazine has a molecular weight of 235.29 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diphenyl-1H-1,3,5-triazine is sourced from PubChem (CID 151250872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).