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

C6H12N4O — CID 15337654

IUPAC4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide
SMILES[H]/N=C(\N)N1CC(C)(C)NC1=O
InChIInChI=1S/C6H12N4O/c1-6(2)3-10(4(7)8)5(11)9-6/h3H2,1-2H3,(H3,7,8)(H,9,11)
InChIKeyIXPCHRDFJPINFB-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.32
Rot. Bonds

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

4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide (PubChem CID 15337654) has the molecular formula C6H12N4O and a molecular weight of 156.19 g/mol. Its IUPAC name is 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide.

Molecular Properties

Compound Name4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide
PubChem CID15337654
Molecular FormulaC6H12N4O
Molecular Weight156.19 g/mol
Exact Mass156.10
IUPAC Name4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide
SMILES[H]/N=C(\N)N1CC(C)(C)NC1=O
InChIInChI=1S/C6H12N4O/c1-6(2)3-10(4(7)8)5(11)9-6/h3H2,1-2H3,(H3,7,8)(H,9,11)
InChIKeyIXPCHRDFJPINFB-UHFFFAOYSA-N
XLogP-0.32
TPSA82.21 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide?
The IUPAC name of 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide (CID 15337654) is 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide.
What is the SMILES notation for 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide?
The canonical SMILES for 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide is [H]/N=C(\N)N1CC(C)(C)NC1=O.
What is the InChIKey of 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide?
The InChIKey is IXPCHRDFJPINFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O/c1-6(2)3-10(4(7)8)5(11)9-6/h3H2,1-2H3,(H3,7,8)(H,9,11).
What are the key properties of 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide?
4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide has a molecular weight of 156.19 g/mol, XLogP of -0.32, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-2-oxoimidazolidine-1-carboximidamide is sourced from PubChem (CID 15337654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).