5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine

C11H20N4O — CID 105362370

IUPAC5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine
SMILESCCc1nnc(NC(C)COC)nc1CC
InChIInChI=1S/C11H20N4O/c1-5-9-10(6-2)14-15-11(13-9)12-8(3)7-16-4/h8H,5-7H2,1-4H3,(H,12,13,15)
InChIKeyUTCGHJIWLLNDNU-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.44
Rot. Bonds6

About 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine

5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine (PubChem CID 105362370) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine.

Molecular Properties

Compound Name5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine
PubChem CID105362370
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine
SMILESCCc1nnc(NC(C)COC)nc1CC
InChIInChI=1S/C11H20N4O/c1-5-9-10(6-2)14-15-11(13-9)12-8(3)7-16-4/h8H,5-7H2,1-4H3,(H,12,13,15)
InChIKeyUTCGHJIWLLNDNU-UHFFFAOYSA-N
XLogP1.44
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(5,6-Diethyl-1,2,4-triazin-3-yl)amino]-1,1,1-trifluoropropan-2-ol
CID 102677457
5,6-diethyl-N-(2,2,2-trifluoroethyl)-1,2,4-triazin-3-amine
CID 105362384
5,6-diethyl-N-(3,3,3-trifluoropropyl)-1,2,4-triazin-3-amine
CID 105362627
5,6-diethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]-1,2,4-triazin-3-amine
CID 105362647
N-(2,2-difluoroethyl)-5,6-diethyl-1,2,4-triazin-3-amine
CID 105362760
5,6-diethyl-N-(4,4,4-trifluorobutyl)-1,2,4-triazin-3-amine
CID 105362761
5,6-diethyl-N-(5,5,5-trifluoropentyl)-1,2,4-triazin-3-amine
CID 105362762
3-[(5,6-Diethyl-1,2,4-triazin-3-yl)amino]-1,1-difluoropropan-2-ol
CID 106544609
3-[(5,6-Diethyl-1,2,4-triazin-3-yl)amino]-2,2-difluoropropan-1-ol
CID 106545027
N'-(5,6-diethyl-1,2,4-triazin-3-yl)-2,2-difluoropropane-1,3-diamine
CID 113707801
5,6-diethyl-N-(4,4,4-trifluorobutan-2-yl)-1,2,4-triazin-3-amine
CID 113847669
5,6-dimethyl-N-[(3R)-1-(oxetan-3-yl)piperidin-3-yl]-1,2,4-triazin-3-amine
CID 176918085

Frequently Asked Questions

What is the IUPAC name of 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine?
The IUPAC name of 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine (CID 105362370) is 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine.
What is the SMILES notation for 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine?
The canonical SMILES for 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine is CCc1nnc(NC(C)COC)nc1CC.
What is the InChIKey of 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine?
The InChIKey is UTCGHJIWLLNDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-5-9-10(6-2)14-15-11(13-9)12-8(3)7-16-4/h8H,5-7H2,1-4H3,(H,12,13,15).
What are the key properties of 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine?
5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine has a molecular weight of 224.31 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diethyl-N-(1-methoxypropan-2-yl)-1,2,4-triazin-3-amine is sourced from PubChem (CID 105362370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).