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

C7H11F2N5 — CID 130722292

IUPAC2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCc1nc(N)nc(NCCC(F)F)n1
InChIInChI=1S/C7H11F2N5/c1-4-12-6(10)14-7(13-4)11-3-2-5(8)9/h5H,2-3H2,1H3,(H3,10,11,12,13,14)
InChIKeyUGPINAOBUQCGRH-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.83
Rot. Bonds4

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

2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 130722292) has the molecular formula C7H11F2N5 and a molecular weight of 203.20 g/mol. Its IUPAC name is 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine
PubChem CID130722292
Molecular FormulaC7H11F2N5
Molecular Weight203.20 g/mol
Exact Mass203.10
IUPAC Name2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCc1nc(N)nc(NCCC(F)F)n1
InChIInChI=1S/C7H11F2N5/c1-4-12-6(10)14-7(13-4)11-3-2-5(8)9/h5H,2-3H2,1H3,(H3,10,11,12,13,14)
InChIKeyUGPINAOBUQCGRH-UHFFFAOYSA-N
XLogP0.83
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1,3,5-Triazine-2,4-diamine, N,N'-diethyl-6-(trifluoromethyl)-
CID 12871
N~2~,N~4~-Diethyl-6-methyl-1,3,5-triazine-2,4-diamine
CID 16086
s-Triazine, 4,6-bis(isopropylamino)-2-ethyl-
CID 33405
1,3,5-Triazin-2-amine, 4-chloro-N-ethyl-6-propyl-
CID 3044738
s-Triazine, 2-methyl-4-methylamino-6-(trifluoromethyl)-
CID 3041947
s-Triazine, 2-dimethylamino-4-isopropylamino-6-(trifluoromethyl)-
CID 3041954
s-Triazine, 2-isopropylamino-4-methylamino-6-trifluoromethyl-
CID 3041963
N~2~-(Butan-2-yl)-6-(trifluoromethyl)-1,3,5-triazine-2,4(1H,3H)-diimine
CID 3041965
1,3,5-Triazin-2-amine, N-ethyl-4-methyl-6-(trifluoromethyl)-
CID 3041968
1,3,5-Triazin-2-amine, N-cyclohexyl-4-methyl-6-(trifluoromethyl)-
CID 3041969
s-Triazine, 2-amino-4-isopropylamino-6-trifluoromethyl-
CID 3041987
N~2~,N~4~,6-Trimethyl-1,3,5-triazine-2,4-diamine
CID 16085

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine (CID 130722292) is 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine is Cc1nc(N)nc(NCCC(F)F)n1.
What is the InChIKey of 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is UGPINAOBUQCGRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2N5/c1-4-12-6(10)14-7(13-4)11-3-2-5(8)9/h5H,2-3H2,1H3,(H3,10,11,12,13,14).
What are the key properties of 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine?
2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 203.20 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,3-difluoropropyl)-6-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 130722292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).