1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine

C16H42N6O7S2 — CID 157177143

IUPAC1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine
SMILESC=C(NC)N(C)C.C=C(NC)OC.CNC(C)=O.CNS(=O)(=O)OC.CNS(C)(=O)=O
InChIInChI=1S/C5H12N2.C4H9NO.C3H7NO.C2H7NO3S.C2H7NO2S/c1-5(6-2)7(3)4;1-4(5-2)6-3;1-3(5)4-2;1-3-7(4,5)6-2;1-3-6(2,4)5/h6H,1H2,2-4H3;5H,1H2,2-3H3;1-2H3,(H,4,5);3H,1-2H3;3H,1-2H3
InChIKeyAODJRJZFZINCDE-UHFFFAOYSA-N
MW494.68 g/mol
LogP-1.42
Rot. Bonds7

About 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine

1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine (PubChem CID 157177143) has the molecular formula C16H42N6O7S2 and a molecular weight of 494.68 g/mol. Its IUPAC name is 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine.

Molecular Properties

Compound Name1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine
PubChem CID157177143
Molecular FormulaC16H42N6O7S2
Molecular Weight494.68 g/mol
Exact Mass494.26
IUPAC Name1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine
SMILESC=C(NC)N(C)C.C=C(NC)OC.CNC(C)=O.CNS(=O)(=O)OC.CNS(C)(=O)=O
InChIInChI=1S/C5H12N2.C4H9NO.C3H7NO.C2H7NO3S.C2H7NO2S/c1-5(6-2)7(3)4;1-4(5-2)6-3;1-3(5)4-2;1-3-7(4,5)6-2;1-3-6(2,4)5/h6H,1H2,2-4H3;5H,1H2,2-3H3;1-2H3,(H,4,5);3H,1-2H3;3H,1-2H3
InChIKeyAODJRJZFZINCDE-UHFFFAOYSA-N
XLogP-1.42
TPSA167.20 Ų
H-Bond Donors5
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500494.68
LogP ≤ 5-1.42
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

1-methoxy-N-methylethenamine
CID 22975960
acetamide;acetic acid;N,N-dimethylacetamide;N,N-dimethylmethanamine;bis(N,N-dimethylmethanesulfonamide);methane;methanesulfonamide;N-methylacetamide;methyl acetate;N-methylmethanamine;tris(N-methylmethanesulfonamide);methylsulfonylmethane
CID 158597077
methane;propane;1-N,1-N',1-N'-trimethylethene-1,1-diamine
CID 158711971
pentakis(N-methylacetamide);N-methylethanesulfonamide;bis(N-methylmethanesulfonamide);bis(N-methylpropanamide)
CID 162162754
methane;N-methylacetamide;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)methanesulfonamide
CID 164997769
1,3-dimethylurea;methoxyethane;N-methylacetamide;methyl acetate;N-methylethanamine;N-methylmethanesulfonamide;N-(methylsulfamoyl)methanamine
CID 159986809
N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide
CID 165098180
formaldehyde;N-methylacetamide
CID 159490973
N-[1-[ethoxy(methylsulfonyl)amino]ethenyl]acetamide
CID 129202774
methoxymethane;2-methylbut-1-ene;bis(3-methylidenepentane);N-methylmethanesulfonamide;propane
CID 162252255
methane;N-methylacetamide
CID 169425645
bis(N-methylacetamide);propan-2-one
CID 158104043

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine?
The IUPAC name of 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine (CID 157177143) is 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine.
What is the SMILES notation for 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine?
The canonical SMILES for 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine is C=C(NC)N(C)C.C=C(NC)OC.CNC(C)=O.CNS(=O)(=O)OC.CNS(C)(=O)=O.
What is the InChIKey of 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine?
The InChIKey is AODJRJZFZINCDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2.C4H9NO.C3H7NO.C2H7NO3S.C2H7NO2S/c1-5(6-2)7(3)4;1-4(5-2)6-3;1-3(5)4-2;1-3-7(4,5)6-2;1-3-6(2,4)5/h6H,1H2,2-4H3;5H,1H2,2-3H3;1-2H3,(H,4,5);3H,1-2H3;3H,1-2H3.
What are the key properties of 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine?
1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine has a molecular weight of 494.68 g/mol, XLogP of -1.42, 7 rotatable bonds, 5 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-methylethenamine;N-methylacetamide;N-methylmethanesulfonamide;methyl N-methylsulfamate;1-N,1-N',1-N'-trimethylethene-1,1-diamine is sourced from PubChem (CID 157177143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).