N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide

C6H12N4O — CID 45088457

IUPACN',1-dimethyl-2-oxoimidazolidine-4-carboximidamide
SMILESC/N=C(\N)C1CN(C)C(=O)N1
InChIInChI=1S/C6H12N4O/c1-8-5(7)4-3-10(2)6(11)9-4/h4H,3H2,1-2H3,(H2,7,8)(H,9,11)
InChIKeyGRMUPWMFJBZCEB-UHFFFAOYSA-N
MW156.19 g/mol
LogP-1.00
Rot. Bonds1

About N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide

N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide (PubChem CID 45088457) has the molecular formula C6H12N4O and a molecular weight of 156.19 g/mol. Its IUPAC name is N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide.

Molecular Properties

Compound NameN',1-dimethyl-2-oxoimidazolidine-4-carboximidamide
PubChem CID45088457
Molecular FormulaC6H12N4O
Molecular Weight156.19 g/mol
Exact Mass156.10
IUPAC NameN',1-dimethyl-2-oxoimidazolidine-4-carboximidamide
SMILESC/N=C(\N)C1CN(C)C(=O)N1
InChIInChI=1S/C6H12N4O/c1-8-5(7)4-3-10(2)6(11)9-4/h4H,3H2,1-2H3,(H2,7,8)(H,9,11)
InChIKeyGRMUPWMFJBZCEB-UHFFFAOYSA-N
XLogP-1.00
TPSA70.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N',1-dimethyl-2-oxoimidazolidine-4-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 N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide?
The IUPAC name of N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide (CID 45088457) is N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide.
What is the SMILES notation for N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide?
The canonical SMILES for N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide is C/N=C(\N)C1CN(C)C(=O)N1.
What is the InChIKey of N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide?
The InChIKey is GRMUPWMFJBZCEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O/c1-8-5(7)4-3-10(2)6(11)9-4/h4H,3H2,1-2H3,(H2,7,8)(H,9,11).
What are the key properties of N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide?
N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide has a molecular weight of 156.19 g/mol, XLogP of -1.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',1-dimethyl-2-oxoimidazolidine-4-carboximidamide is sourced from PubChem (CID 45088457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).