1-hydroxy-2-(2-methoxyethyl)guanidine

C4H11N3O2 — CID 62482674

IUPAC1-hydroxy-2-(2-methoxyethyl)guanidine
SMILESCOCC/N=C(\N)NO
InChIInChI=1S/C4H11N3O2/c1-9-3-2-6-4(5)7-8/h8H,2-3H2,1H3,(H3,5,6,7)
InChIKeyWIEYNNVFEGLTIQ-UHFFFAOYSA-N
MW133.15 g/mol
LogP-1.07
Rot. Bonds3

About 1-hydroxy-2-(2-methoxyethyl)guanidine

1-hydroxy-2-(2-methoxyethyl)guanidine (PubChem CID 62482674) has the molecular formula C4H11N3O2 and a molecular weight of 133.15 g/mol. Its IUPAC name is 1-hydroxy-2-(2-methoxyethyl)guanidine.

Molecular Properties

Compound Name1-hydroxy-2-(2-methoxyethyl)guanidine
PubChem CID62482674
Molecular FormulaC4H11N3O2
Molecular Weight133.15 g/mol
Exact Mass133.09
IUPAC Name1-hydroxy-2-(2-methoxyethyl)guanidine
SMILESCOCC/N=C(\N)NO
InChIInChI=1S/C4H11N3O2/c1-9-3-2-6-4(5)7-8/h8H,2-3H2,1H3,(H3,5,6,7)
InChIKeyWIEYNNVFEGLTIQ-UHFFFAOYSA-N
XLogP-1.07
TPSA79.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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

1-hydroxy-2-(2-propan-2-yloxyethyl)guanidine
CID 104765885
[N'-(2-methoxyethyl)carbamimidoyl]thiourea
CID 19439671
1-carbamimidoyl-2-(2-methoxyethyl)guanidine
CID 176521934
ethane;1-hydroxy-2-propylguanidine
CID 162518458
2-[2-[[amino-(hydroxyamino)methylidene]amino]ethoxy]acetamide
CID 106241335
2-[2-(2-methoxyethoxy)ethyl]-1-(2-methoxyethyl)guanidine
CID 110918294
1-amino-2-(4-methoxybutyl)guanidine
CID 64866664
N-[2-[[N'-(2-methoxyethyl)carbamimidoyl]amino]ethyl]cyclopropanecarboxamide
CID 110913777
N-amino-N'-(2-methoxyethyl)butanimidamide
CID 62544957
1-hydroxy-2-(4-methoxybutan-2-yl)guanidine
CID 64604532
3-[[amino-(hydroxyamino)methylidene]amino]propylazanium
CID 5287648
1-(2-tert-butylsulfinylethyl)-2-(2-methoxyethyl)guanidine
CID 111424463

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2-(2-methoxyethyl)guanidine?
The IUPAC name of 1-hydroxy-2-(2-methoxyethyl)guanidine (CID 62482674) is 1-hydroxy-2-(2-methoxyethyl)guanidine.
What is the SMILES notation for 1-hydroxy-2-(2-methoxyethyl)guanidine?
The canonical SMILES for 1-hydroxy-2-(2-methoxyethyl)guanidine is COCC/N=C(\N)NO.
What is the InChIKey of 1-hydroxy-2-(2-methoxyethyl)guanidine?
The InChIKey is WIEYNNVFEGLTIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3O2/c1-9-3-2-6-4(5)7-8/h8H,2-3H2,1H3,(H3,5,6,7).
What are the key properties of 1-hydroxy-2-(2-methoxyethyl)guanidine?
1-hydroxy-2-(2-methoxyethyl)guanidine has a molecular weight of 133.15 g/mol, XLogP of -1.07, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2-(2-methoxyethyl)guanidine is sourced from PubChem (CID 62482674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).