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

C5H6F3N5O — CID 15010397

IUPAC2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(OC(F)(F)F)n1
InChIInChI=1S/C5H6F3N5O/c1-10-3-11-2(9)12-4(13-3)14-5(6,7)8/h1H3,(H3,9,10,11,12,13)
InChIKeyUTFHQWAJZDQKJN-UHFFFAOYSA-N
MW209.13 g/mol
LogP0.39
Rot. Bonds2

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

2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine (PubChem CID 15010397) has the molecular formula C5H6F3N5O and a molecular weight of 209.13 g/mol. Its IUPAC name is 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine
PubChem CID15010397
Molecular FormulaC5H6F3N5O
Molecular Weight209.13 g/mol
Exact Mass209.05
IUPAC Name2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(OC(F)(F)F)n1
InChIInChI=1S/C5H6F3N5O/c1-10-3-11-2(9)12-4(13-3)14-5(6,7)8/h1H3,(H3,9,10,11,12,13)
InChIKeyUTFHQWAJZDQKJN-UHFFFAOYSA-N
XLogP0.39
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.13
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

Stk076603
CID 1375559
2-N,4-N-dimethyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine
CID 15010389
4-Fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine
CID 15010390
4-[chloro(difluoro)methoxy]-6-fluoro-N-methyl-1,3,5-triazin-2-amine
CID 15010391
6-[chloro(difluoro)methoxy]-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 15010392
2-Amino-4-methoxy-6-trifluoromethoxy-1,3,5-triazine
CID 15010393
6-[chloro(difluoro)methoxy]-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 15010398
2-Amino-4-dimethylamino-6-trifluoromethoxy-1,3,5-triazine
CID 15010399
6-[chloro(difluoro)methoxy]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 15010400
4-chloro-6-[chloro(difluoro)methoxy]-N-methyl-1,3,5-triazin-2-amine
CID 19006216
N-methyl-4,6-bis(trifluoromethoxy)-1,3,5-triazin-2-amine
CID 19006221
4-chloro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine
CID 19006228

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine (CID 15010397) is 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine is CNc1nc(N)nc(OC(F)(F)F)n1.
What is the InChIKey of 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine?
The InChIKey is UTFHQWAJZDQKJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F3N5O/c1-10-3-11-2(9)12-4(13-3)14-5(6,7)8/h1H3,(H3,9,10,11,12,13).
What are the key properties of 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine?
2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine has a molecular weight of 209.13 g/mol, XLogP of 0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6-(trifluoromethoxy)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 15010397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).