5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione

C10H11N3O3 — CID 123480725

IUPAC5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(c2ccc(=O)[nH]c2)C1=O
InChIInChI=1S/C10H11N3O3/c1-10(2)8(15)13(9(16)12-10)6-3-4-7(14)11-5-6/h3-5H,1-2H3,(H,11,14)(H,12,16)
InChIKeyQJNGNEFENGJTES-UHFFFAOYSA-N
MW221.22 g/mol
LogP0.21
Rot. Bonds1

About 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione

5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione (PubChem CID 123480725) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione
PubChem CID123480725
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Name5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(c2ccc(=O)[nH]c2)C1=O
InChIInChI=1S/C10H11N3O3/c1-10(2)8(15)13(9(16)12-10)6-3-4-7(14)11-5-6/h3-5H,1-2H3,(H,11,14)(H,12,16)
InChIKeyQJNGNEFENGJTES-UHFFFAOYSA-N
XLogP0.21
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2,4-hexadienamide
CID 2053608
Cambridge id 5533113
CID 2850500
(5S)-3-(1-ethyl-6-oxo-3-pyridinyl)-5-methyl-1-propylimidazolidine-2,4-dione
CID 124259012
3-(3-propanoylimidazolidine-1-carbonyl)-1H-pyridin-2-one
CID 128893068
6-[1-(Difluoromethyl)-2-oxo-4-pyridinyl]-4,6-diazaspiro[2.4]heptane-5,7-dione
CID 168981840
6-(5-Fluoro-1-methyl-2-oxo-4-pyridinyl)-4,6-diazaspiro[2.4]heptane-5,7-dione
CID 168982119
1-(1,2-Dihydro-1-methyl-2-oxo-3-pyridinyl)dihydro-2,4(1H,3H)-pyrimidinedione
CID 155261434
Aminopyridinedicarboximide
CID 129809085
2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]-N-(propylcarbamoyl)acetamide
CID 24244270
N-(methylcarbamoyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 24244402
1-[2-Oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-3-(trifluoromethyl)pyridin-2-one
CID 25537583
5,5-Dimethyl-3-[2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]ethyl]imidazolidine-2,4-dione
CID 38652523

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione (CID 123480725) is 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione is CC1(C)NC(=O)N(c2ccc(=O)[nH]c2)C1=O.
What is the InChIKey of 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione?
The InChIKey is QJNGNEFENGJTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c1-10(2)8(15)13(9(16)12-10)6-3-4-7(14)11-5-6/h3-5H,1-2H3,(H,11,14)(H,12,16).
What are the key properties of 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione?
5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione has a molecular weight of 221.22 g/mol, XLogP of 0.21, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-(6-oxo-1H-pyridin-3-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 123480725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).