N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide

C8H19N3O — CID 62544152

IUPACN-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide
SMILESCOCC/N=C(\NN)C(C)(C)C
InChIInChI=1S/C8H19N3O/c1-8(2,3)7(11-9)10-5-6-12-4/h5-6,9H2,1-4H3,(H,10,11)
InChIKeyOKEUFVBOLCHESD-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.54
Rot. Bonds3

About N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide

N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide (PubChem CID 62544152) has the molecular formula C8H19N3O and a molecular weight of 173.26 g/mol. Its IUPAC name is N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide.

Molecular Properties

Compound NameN-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide
PubChem CID62544152
Molecular FormulaC8H19N3O
Molecular Weight173.26 g/mol
Exact Mass173.15
IUPAC NameN-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide
SMILESCOCC/N=C(\NN)C(C)(C)C
InChIInChI=1S/C8H19N3O/c1-8(2,3)7(11-9)10-5-6-12-4/h5-6,9H2,1-4H3,(H,10,11)
InChIKeyOKEUFVBOLCHESD-UHFFFAOYSA-N
XLogP0.54
TPSA59.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-amino-N'-(2-methoxyethyl)-3,3-dimethylbutanimidamide
CID 62543671
3-amino-1,1,2-tris(2-methoxyethyl)guanidine
CID 104885360
N-amino-N'-(2-methoxyethyl)butanimidamide
CID 62544957
3-[[N-amino-N'-(2-methoxyethyl)carbamimidoyl]amino]propanamide
CID 104883842
1-hydroxy-2-(2-methoxyethyl)guanidine
CID 62482674
1-amino-3-(3-ethylpentan-2-yl)-2-(2-methoxyethyl)guanidine
CID 104886038
N'-(2-methoxyethyl)-3-methylbutanimidamide
CID 63181243
N-amino-N'-(2-methoxyethyl)thiadiazole-5-carboximidamide
CID 65215060
[N'-(2-methoxyethyl)carbamimidoyl]thiourea
CID 19439671
1-amino-2-(4-methoxybutyl)guanidine
CID 64866664
N'-(4-methoxybutyl)-2,2-dimethylpropanimidamide
CID 63177169
1-tert-butyl-2-(5-methoxypentyl)guanidine
CID 103646401

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide?
The IUPAC name of N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide (CID 62544152) is N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide.
What is the SMILES notation for N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide?
The canonical SMILES for N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide is COCC/N=C(\NN)C(C)(C)C.
What is the InChIKey of N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide?
The InChIKey is OKEUFVBOLCHESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O/c1-8(2,3)7(11-9)10-5-6-12-4/h5-6,9H2,1-4H3,(H,10,11).
What are the key properties of N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide?
N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide has a molecular weight of 173.26 g/mol, XLogP of 0.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-(2-methoxyethyl)-2,2-dimethylpropanimidamide is sourced from PubChem (CID 62544152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).