1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine

C10H20N4O2 — CID 47083308

IUPAC1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine
SMILESCOCCN/C(N)=N/CC(=O)N1CCCC1
InChIInChI=1S/C10H20N4O2/c1-16-7-4-12-10(11)13-8-9(15)14-5-2-3-6-14/h2-8H2,1H3,(H3,11,12,13)
InChIKeyMAYKTEZSKBEEGU-UHFFFAOYSA-N
MW228.30 g/mol
LogP-0.84
Rot. Bonds5

About 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine

1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine (PubChem CID 47083308) has the molecular formula C10H20N4O2 and a molecular weight of 228.30 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine
PubChem CID47083308
Molecular FormulaC10H20N4O2
Molecular Weight228.30 g/mol
Exact Mass228.16
IUPAC Name1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine
SMILESCOCCN/C(N)=N/CC(=O)N1CCCC1
InChIInChI=1S/C10H20N4O2/c1-16-7-4-12-10(11)13-8-9(15)14-5-2-3-6-14/h2-8H2,1H3,(H3,11,12,13)
InChIKeyMAYKTEZSKBEEGU-UHFFFAOYSA-N
XLogP-0.84
TPSA79.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
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'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine?
The IUPAC name of 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine (CID 47083308) is 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine.
What is the SMILES notation for 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine?
The canonical SMILES for 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine is COCCN/C(N)=N/CC(=O)N1CCCC1.
What is the InChIKey of 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine?
The InChIKey is MAYKTEZSKBEEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O2/c1-16-7-4-12-10(11)13-8-9(15)14-5-2-3-6-14/h2-8H2,1H3,(H3,11,12,13).
What are the key properties of 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine?
1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine has a molecular weight of 228.30 g/mol, XLogP of -0.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)guanidine is sourced from PubChem (CID 47083308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).