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

C7H10F3N5O — CID 174564300

IUPAC2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(N)nc(OC(F)C(F)F)n1
InChIInChI=1S/C7H10F3N5O/c1-15(2)6-12-5(11)13-7(14-6)16-4(10)3(8)9/h3-4H,1-2H3,(H2,11,12,13,14)
InChIKeyWLRJLGOGISWYPD-UHFFFAOYSA-N
MW237.19 g/mol
LogP0.46
Rot. Bonds4

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

2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine (PubChem CID 174564300) has the molecular formula C7H10F3N5O and a molecular weight of 237.19 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine
PubChem CID174564300
Molecular FormulaC7H10F3N5O
Molecular Weight237.19 g/mol
Exact Mass237.08
IUPAC Name2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(N)nc(OC(F)C(F)F)n1
InChIInChI=1S/C7H10F3N5O/c1-15(2)6-12-5(11)13-7(14-6)16-4(10)3(8)9/h3-4H,1-2H3,(H2,11,12,13,14)
InChIKeyWLRJLGOGISWYPD-UHFFFAOYSA-N
XLogP0.46
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.19
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1,3,5-Triazine-2,4-diamine, N2,N2-dimethyl-6-(2,2,2-trifluoroethoxy)-
CID 10933513
Stk076603
CID 1375559
6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine
CID 139595246
2-Amino-6-ethoxy-4-methylamino-1,3,5-triazine
CID 693795
s-Triazine, 4,6-diamino-2-ethoxy-
CID 17802
N-Methyl-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazine-2,4-diamine
CID 625950
4,6-Bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 1375552
N-methyl-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 1375553
1,3,5-Triazin-2-amine, 4-methoxy-6-(2,2,2-trifluoroethoxy)-
CID 180958
2-Amino-4-ethoxy-6-trifluoromethoxy-1,3,5-triazine
CID 15010395
4-[Chloro(difluoro)methoxy]-6-ethoxy-1,3,5-triazin-2-amine
CID 15010396
2-Amino-4-dimethylamino-6-trifluoromethoxy-1,3,5-triazine
CID 15010399

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine (CID 174564300) is 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine is CN(C)c1nc(N)nc(OC(F)C(F)F)n1.
What is the InChIKey of 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine?
The InChIKey is WLRJLGOGISWYPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3N5O/c1-15(2)6-12-5(11)13-7(14-6)16-4(10)3(8)9/h3-4H,1-2H3,(H2,11,12,13,14).
What are the key properties of 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine?
2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine has a molecular weight of 237.19 g/mol, XLogP of 0.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 174564300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).