6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine

C10H10FN5 — CID 112681364

IUPAC6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine
SMILESCc1cccc(-c2nc(N)nc(N)n2)c1F
InChIInChI=1S/C10H10FN5/c1-5-3-2-4-6(7(5)11)8-14-9(12)16-10(13)15-8/h2-4H,1H3,(H4,12,13,14,15,16)
InChIKeyRFRNCFGSEACTNQ-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.15
Rot. Bonds1

About 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine

6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine (PubChem CID 112681364) has the molecular formula C10H10FN5 and a molecular weight of 219.22 g/mol. Its IUPAC name is 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine
PubChem CID112681364
Molecular FormulaC10H10FN5
Molecular Weight219.22 g/mol
Exact Mass219.09
IUPAC Name6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine
SMILESCc1cccc(-c2nc(N)nc(N)n2)c1F
InChIInChI=1S/C10H10FN5/c1-5-3-2-4-6(7(5)11)8-14-9(12)16-10(13)15-8/h2-4H,1H3,(H4,12,13,14,15,16)
InChIKeyRFRNCFGSEACTNQ-UHFFFAOYSA-N
XLogP1.15
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-6-(2-fluoro-3-methylphenyl)-1,3,5-triazin-2-amine
CID 83240116
6-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 2730671
4,6-bis(2,3-dimethylphenyl)-1,3,5-triazin-2-amine
CID 155659770
2-(2-fluoro-3-methylphenyl)-5-methylquinazolin-4-amine
CID 81478771
3-(4,6-diamino-1,3,5-triazin-2-yl)-2-methylphenol
CID 112681318
5-(2-fluoro-3-methylphenyl)naphthalen-1-amine
CID 172677687
4-(2-fluorophenyl)-6-methyl-1,3,5-triazin-2-amine
CID 82469916
4-chloro-2-(2-fluoro-3-methylphenyl)-5-methylquinazoline
CID 81481875
2-(2-fluoro-3-methylphenyl)-1,3-thiazol-4-amine
CID 107113816
4-(2-fluoro-3-methylphenyl)aniline
CID 83394762
4-chloro-6-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3,5-triazin-2-amine
CID 83240914
6-(2,3-dichlorophenyl)-1,3,5-triazine-2,4-diamine
CID 12852436

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine (CID 112681364) is 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine is Cc1cccc(-c2nc(N)nc(N)n2)c1F.
What is the InChIKey of 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is RFRNCFGSEACTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN5/c1-5-3-2-4-6(7(5)11)8-14-9(12)16-10(13)15-8/h2-4H,1H3,(H4,12,13,14,15,16).
What are the key properties of 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine?
6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 219.22 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-3-methylphenyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 112681364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).