N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide

C8H14IN3O2 — CID 19905885

IUPACN-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide
SMILESCC(C)CN(I)C(=O)N1CCNC1=O
InChIInChI=1S/C8H14IN3O2/c1-6(2)5-12(9)8(14)11-4-3-10-7(11)13/h6H,3-5H2,1-2H3,(H,10,13)
InChIKeyHFQVKMRXZMHIHD-UHFFFAOYSA-N
MW311.12 g/mol
LogP1.44
Rot. Bonds2

About N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide

N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide (PubChem CID 19905885) has the molecular formula C8H14IN3O2 and a molecular weight of 311.12 g/mol. Its IUPAC name is N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide
PubChem CID19905885
Molecular FormulaC8H14IN3O2
Molecular Weight311.12 g/mol
Exact Mass311.01
IUPAC NameN-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide
SMILESCC(C)CN(I)C(=O)N1CCNC1=O
InChIInChI=1S/C8H14IN3O2/c1-6(2)5-12(9)8(14)11-4-3-10-7(11)13/h6H,3-5H2,1-2H3,(H,10,13)
InChIKeyHFQVKMRXZMHIHD-UHFFFAOYSA-N
XLogP1.44
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.12
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

1-butanoylimidazolidin-2-one
CID 12771230
N-ethyl-2-oxo-N-phenylimidazolidine-1-carboxamide
CID 2019740
1-(2-chlorobutanoyl)imidazolidin-2-one
CID 16786747
1-[2-(2-aminopropylsulfanyl)acetyl]imidazolidin-2-one
CID 66218972
methyl 2-oxoimidazolidine-1-carboxylate
CID 11788357
1-(5-methylhexyl)imidazolidin-2-one
CID 115370813
1-(1-hydroxy-4-methylpentan-2-yl)imidazolidin-2-one
CID 104549237
1-(C,N-dimethylcarbonimidoyl)imidazolidin-2-one
CID 145372236
1-[(2R)-2-[(4-chlorophenyl)methyl-methylamino]propanoyl]imidazolidin-2-one
CID 8541173
1-[2-[(1S)-1-(4-chlorophenyl)ethyl]sulfanylacetyl]imidazolidin-2-one
CID 94217685
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoate
CID 46789888
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] (2S)-2-(1,3-dioxoisoindol-2-yl)propanoate
CID 8926353

Frequently Asked Questions

What is the IUPAC name of N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide (CID 19905885) is N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide is CC(C)CN(I)C(=O)N1CCNC1=O.
What is the InChIKey of N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide?
The InChIKey is HFQVKMRXZMHIHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14IN3O2/c1-6(2)5-12(9)8(14)11-4-3-10-7(11)13/h6H,3-5H2,1-2H3,(H,10,13).
What are the key properties of N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide?
N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide has a molecular weight of 311.12 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-iodo-N-(2-methylpropyl)-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 19905885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).