4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine

C15H10Cl2N4 — CID 27647

IUPAC4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine
SMILESClc1nc(Cl)nc(N(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C15H10Cl2N4/c16-13-18-14(17)20-15(19-13)21(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKeyUIKAQTBBQJSDQE-UHFFFAOYSA-N
MW317.18 g/mol
LogP4.65
Rot. Bonds3

About 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine

4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine (PubChem CID 27647) has the molecular formula C15H10Cl2N4 and a molecular weight of 317.18 g/mol. Its IUPAC name is 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine
PubChem CID27647
Molecular FormulaC15H10Cl2N4
Molecular Weight317.18 g/mol
Exact Mass316.03
IUPAC Name4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine
SMILESClc1nc(Cl)nc(N(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C15H10Cl2N4/c16-13-18-14(17)20-15(19-13)21(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKeyUIKAQTBBQJSDQE-UHFFFAOYSA-N
XLogP4.65
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.18
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine (CID 27647) is 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine is Clc1nc(Cl)nc(N(c2ccccc2)c2ccccc2)n1.
What is the InChIKey of 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine?
The InChIKey is UIKAQTBBQJSDQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N4/c16-13-18-14(17)20-15(19-13)21(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H.
What are the key properties of 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine?
4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine has a molecular weight of 317.18 g/mol, XLogP of 4.65, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-N,N-diphenyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 27647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).