2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide

C10H22N4 — CID 62889863

IUPAC2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide
SMILESCC/N=C(\N)N1CCCC1CN(C)C
InChIInChI=1S/C10H22N4/c1-4-12-10(11)14-7-5-6-9(14)8-13(2)3/h9H,4-8H2,1-3H3,(H2,11,12)
InChIKeyUOUXIBHNHYUIPL-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.35
Rot. Bonds3

About 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide

2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide (PubChem CID 62889863) has the molecular formula C10H22N4 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide.

Molecular Properties

Compound Name2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide
PubChem CID62889863
Molecular FormulaC10H22N4
Molecular Weight198.31 g/mol
Exact Mass198.18
IUPAC Name2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide
SMILESCC/N=C(\N)N1CCCC1CN(C)C
InChIInChI=1S/C10H22N4/c1-4-12-10(11)14-7-5-6-9(14)8-13(2)3/h9H,4-8H2,1-3H3,(H2,11,12)
InChIKeyUOUXIBHNHYUIPL-UHFFFAOYSA-N
XLogP0.35
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.35
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'}

Analyze 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide?
The IUPAC name of 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide (CID 62889863) is 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide.
What is the SMILES notation for 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide?
The canonical SMILES for 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide is CC/N=C(\N)N1CCCC1CN(C)C.
What is the InChIKey of 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide?
The InChIKey is UOUXIBHNHYUIPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4/c1-4-12-10(11)14-7-5-6-9(14)8-13(2)3/h9H,4-8H2,1-3H3,(H2,11,12).
What are the key properties of 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide?
2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide has a molecular weight of 198.31 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dimethylamino)methyl]-N'-ethylpyrrolidine-1-carboximidamide is sourced from PubChem (CID 62889863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).