2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine

C9H7F2N5 — CID 2730207

IUPAC2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine
SMILESNc1ncnc(Nc2c(F)cccc2F)n1
InChIInChI=1S/C9H7F2N5/c10-5-2-1-3-6(11)7(5)15-9-14-4-13-8(12)16-9/h1-4H,(H3,12,13,14,15,16)
InChIKeyIQGUHUQTBOVRIR-UHFFFAOYSA-N
MW223.19 g/mol
LogP1.48
Rot. Bonds2

About 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine

2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine (PubChem CID 2730207) has the molecular formula C9H7F2N5 and a molecular weight of 223.19 g/mol. Its IUPAC name is 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine
PubChem CID2730207
Molecular FormulaC9H7F2N5
Molecular Weight223.19 g/mol
Exact Mass223.07
IUPAC Name2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine
SMILESNc1ncnc(Nc2c(F)cccc2F)n1
InChIInChI=1S/C9H7F2N5/c10-5-2-1-3-6(11)7(5)15-9-14-4-13-8(12)16-9/h1-4H,(H3,12,13,14,15,16)
InChIKeyIQGUHUQTBOVRIR-UHFFFAOYSA-N
XLogP1.48
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.19
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Amanozine
CID 10832
2-N-(3-(trifluoromethyl)phenyl)-1,3,5-triazine-2,4-diamine
CID 704906
2-N-(3-fluorophenyl)-1,3,5-triazine-2,4-diamine
CID 2737693
6-chloro-4-N-methyl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 840843
N2-(3-chloro-4-fluorophenyl)-1,3,5-triazine-2,4-diamine
CID 2729981
N-Allyl-6-chloro-N'-phenyl-[1,3,5]triazine-2,4-diamine
CID 3107858
4,6-dichloro-N-phenyl-1,3,5-triazin-2-amine
CID 16766
(4,6-Dimethoxy-[1,3,5]triazin-2-yl)-(2-fluoro-phenyl)-amine
CID 784146
N-(4-Fluoro-phenyl)-6-hydrazino-N',N'-dimethyl-[1,3,5]triazine-2,4-diamine
CID 785754
N,N,N',N'-Tetramethyl-N''-phenyl-[1,3,5]triazine-2,4,6-triamine
CID 1090715
4,6-dichloro-N-(3-fluorophenyl)-1,3,5-triazin-2-amine
CID 1074705
N-[2-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4-diamine
CID 757416

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine (CID 2730207) is 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine is Nc1ncnc(Nc2c(F)cccc2F)n1.
What is the InChIKey of 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is IQGUHUQTBOVRIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F2N5/c10-5-2-1-3-6(11)7(5)15-9-14-4-13-8(12)16-9/h1-4H,(H3,12,13,14,15,16).
What are the key properties of 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine?
2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 223.19 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,6-difluorophenyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 2730207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).