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

C9H20N4 — CID 62890204

IUPAC2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide
SMILESC/N=C(\N)N1CCCC1CN(C)C
InChIInChI=1S/C9H20N4/c1-11-9(10)13-6-4-5-8(13)7-12(2)3/h8H,4-7H2,1-3H3,(H2,10,11)
InChIKeyAYGCYRANEXVFDT-UHFFFAOYSA-N
MW184.29 g/mol
LogP-0.04
Rot. Bonds2

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

2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide (PubChem CID 62890204) has the molecular formula C9H20N4 and a molecular weight of 184.29 g/mol. Its IUPAC name is 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide.

Molecular Properties

Compound Name2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide
PubChem CID62890204
Molecular FormulaC9H20N4
Molecular Weight184.29 g/mol
Exact Mass184.17
IUPAC Name2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide
SMILESC/N=C(\N)N1CCCC1CN(C)C
InChIInChI=1S/C9H20N4/c1-11-9(10)13-6-4-5-8(13)7-12(2)3/h8H,4-7H2,1-3H3,(H2,10,11)
InChIKeyAYGCYRANEXVFDT-UHFFFAOYSA-N
XLogP-0.04
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.29
LogP ≤ 5-0.04
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'-methylpyrrolidine-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'-methylpyrrolidine-1-carboximidamide?
The IUPAC name of 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide (CID 62890204) is 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide.
What is the SMILES notation for 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide?
The canonical SMILES for 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide is C/N=C(\N)N1CCCC1CN(C)C.
What is the InChIKey of 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide?
The InChIKey is AYGCYRANEXVFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4/c1-11-9(10)13-6-4-5-8(13)7-12(2)3/h8H,4-7H2,1-3H3,(H2,10,11).
What are the key properties of 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide?
2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide has a molecular weight of 184.29 g/mol, XLogP of -0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dimethylamino)methyl]-N'-methylpyrrolidine-1-carboximidamide is sourced from PubChem (CID 62890204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).