2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide

C12H23N7O — CID 80780070

IUPAC2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide
SMILESCCN(CC)c1nc(N)nc(N(C)CC(=O)N(C)C)n1
InChIInChI=1S/C12H23N7O/c1-6-19(7-2)12-15-10(13)14-11(16-12)18(5)8-9(20)17(3)4/h6-8H2,1-5H3,(H2,13,14,15,16)
InChIKeyYHZWINNDWIOMIS-UHFFFAOYSA-N
MW281.36 g/mol
LogP-0.18
Rot. Bonds6

About 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide

2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide (PubChem CID 80780070) has the molecular formula C12H23N7O and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide
PubChem CID80780070
Molecular FormulaC12H23N7O
Molecular Weight281.36 g/mol
Exact Mass281.20
IUPAC Name2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide
SMILESCCN(CC)c1nc(N)nc(N(C)CC(=O)N(C)C)n1
InChIInChI=1S/C12H23N7O/c1-6-19(7-2)12-15-10(13)14-11(16-12)18(5)8-9(20)17(3)4/h6-8H2,1-5H3,(H2,13,14,15,16)
InChIKeyYHZWINNDWIOMIS-UHFFFAOYSA-N
XLogP-0.18
TPSA91.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-ethylamino]-N,N-dimethylacetamide
CID 80809834
2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80774543
2-[(5-amino-1H-1,2,4-triazol-3-yl)-ethylamino]-N,N-dimethylacetamide
CID 66277129
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-ethylamino]-N-methylacetamide
CID 80808876
[(4,6-diamino-1,3,5-triazin-2-yl)-ethylamino]methanol
CID 18793710
2-N,2-N-diethyl-4-N-methyl-4-N-(2-methylsulfanylethyl)-1,3,5-triazine-2,4,6-triamine
CID 112667625
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-propan-2-ylamino]acetamide
CID 80805910
2-[(4-amino-6-chloro-1,3,5-triazin-2-yl)-ethylamino]acetamide
CID 103104377
N-[4-(diethylamino)-6-[hydroxy(methyl)amino]-1,3,5-triazin-2-yl]-N-methylhydroxylamine
CID 21135101
2-[[2-amino-6-(methylamino)pyrimidin-4-yl]-ethylamino]-N,N-dimethylacetamide
CID 80809651
2-[(2-aminopyrimidin-4-yl)-ethylamino]-N,N-dimethylacetamide
CID 80809739
2-N-[2-(dimethylamino)ethyl]-4-N,4-N-diethyl-2-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80795919

Frequently Asked Questions

What is the IUPAC name of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide (CID 80780070) is 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide is CCN(CC)c1nc(N)nc(N(C)CC(=O)N(C)C)n1.
What is the InChIKey of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide?
The InChIKey is YHZWINNDWIOMIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N7O/c1-6-19(7-2)12-15-10(13)14-11(16-12)18(5)8-9(20)17(3)4/h6-8H2,1-5H3,(H2,13,14,15,16).
What are the key properties of 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide?
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide has a molecular weight of 281.36 g/mol, XLogP of -0.18, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-methylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 80780070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).