1-(2-methoxyethyl)-1,2-dimethylguanidine

C6H15N3O — CID 62359692

IUPAC1-(2-methoxyethyl)-1,2-dimethylguanidine
SMILESC/N=C(\N)N(C)CCOC
InChIInChI=1S/C6H15N3O/c1-8-6(7)9(2)4-5-10-3/h4-5H2,1-3H3,(H2,7,8)
InChIKeyZHIUBGDJRIJRNW-UHFFFAOYSA-N
MW145.21 g/mol
LogP-0.49
Rot. Bonds3

About 1-(2-methoxyethyl)-1,2-dimethylguanidine

1-(2-methoxyethyl)-1,2-dimethylguanidine (PubChem CID 62359692) has the molecular formula C6H15N3O and a molecular weight of 145.21 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-1,2-dimethylguanidine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-1,2-dimethylguanidine
PubChem CID62359692
Molecular FormulaC6H15N3O
Molecular Weight145.21 g/mol
Exact Mass145.12
IUPAC Name1-(2-methoxyethyl)-1,2-dimethylguanidine
SMILESC/N=C(\N)N(C)CCOC
InChIInChI=1S/C6H15N3O/c1-8-6(7)9(2)4-5-10-3/h4-5H2,1-3H3,(H2,7,8)
InChIKeyZHIUBGDJRIJRNW-UHFFFAOYSA-N
XLogP-0.49
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.21
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-(2-Methoxyethyl)-1-methylguanidine
CID 18681253
1,1-Bis(2-methoxyethyl)guanidine
CID 18681337
1-(2-Ethoxyethyl)-1-methylguanidine
CID 18681348
2-(2-Methoxyethyl)-1,1-dimethylguanidine
CID 18727677
1-Ethyl-1-(2-methoxyethyl)guanidine
CID 18952249
1-(2-Methoxyethyl)-2-methylguanidine
CID 18952333
1-Cyano-1-(2-methoxyethyl)guanidine
CID 20552225
[Dimethylamino-(2-methoxyethylamino)methylidene]-dimethylazanium
CID 20688133
N'-methylmorpholine-4-carboximidamide
CID 22977265
1-(2-Ethoxyethyl)-2-methylguanidine
CID 23103866
1,2-Bis(2-methoxyethyl)guanidine
CID 23103924
1-Ethyl-2-(2-methoxyethyl)guanidine
CID 54450721

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-1,2-dimethylguanidine?
The IUPAC name of 1-(2-methoxyethyl)-1,2-dimethylguanidine (CID 62359692) is 1-(2-methoxyethyl)-1,2-dimethylguanidine.
What is the SMILES notation for 1-(2-methoxyethyl)-1,2-dimethylguanidine?
The canonical SMILES for 1-(2-methoxyethyl)-1,2-dimethylguanidine is C/N=C(\N)N(C)CCOC.
What is the InChIKey of 1-(2-methoxyethyl)-1,2-dimethylguanidine?
The InChIKey is ZHIUBGDJRIJRNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O/c1-8-6(7)9(2)4-5-10-3/h4-5H2,1-3H3,(H2,7,8).
What are the key properties of 1-(2-methoxyethyl)-1,2-dimethylguanidine?
1-(2-methoxyethyl)-1,2-dimethylguanidine has a molecular weight of 145.21 g/mol, XLogP of -0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-1,2-dimethylguanidine is sourced from PubChem (CID 62359692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).