3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione

C11H14N4O3 — CID 43259678

IUPAC3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione
SMILESNc1ccc(=O)n(CCCN2C(=O)CNC2=O)c1
InChIInChI=1S/C11H14N4O3/c12-8-2-3-9(16)14(7-8)4-1-5-15-10(17)6-13-11(15)18/h2-3,7H,1,4-6,12H2,(H,13,18)
InChIKeyRLLQNGIVQKMTTD-UHFFFAOYSA-N
MW250.26 g/mol
LogP-0.63
Rot. Bonds4

About 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione

3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione (PubChem CID 43259678) has the molecular formula C11H14N4O3 and a molecular weight of 250.26 g/mol. Its IUPAC name is 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione
PubChem CID43259678
Molecular FormulaC11H14N4O3
Molecular Weight250.26 g/mol
Exact Mass250.11
IUPAC Name3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione
SMILESNc1ccc(=O)n(CCCN2C(=O)CNC2=O)c1
InChIInChI=1S/C11H14N4O3/c12-8-2-3-9(16)14(7-8)4-1-5-15-10(17)6-13-11(15)18/h2-3,7H,1,4-6,12H2,(H,13,18)
InChIKeyRLLQNGIVQKMTTD-UHFFFAOYSA-N
XLogP-0.63
TPSA97.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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
Pyridinedicarboximide
CID 68595150
1-(1,2-Dihydro-1-methyl-2-oxo-3-pyridinyl)dihydro-2,4(1H,3H)-pyrimidinedione
CID 155261434
Aminopyridinedicarboximide
CID 129809085
1-[2-Oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-3-(trifluoromethyl)pyridin-2-one
CID 25537583
N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]pyrrolidine-1-carboxamide
CID 71854665
3-[3-(5-Fluoro-2-oxo-1-pyridinyl)propyl]-5,5-dimethylimidazolidine-2,4-dione
CID 99831350
1-[1-(2,2-Difluoroethyl)pyrrolidin-3-yl]-3-(1-ethyl-2-oxo-3-pyridinyl)urea
CID 138025513
1-(2-oxo-1H-pyridin-3-yl)pyrimidine-2,4-dione
CID 70245197
(5S)-5-[2-(6-oxo-1H-pyridin-2-yl)ethynyl]imidazolidine-2,4-dione
CID 70313563
5-[(Z)-3-(2-methylidene-1-pyridinyl)pent-3-en-1-ynyl]imidazolidine-2,4-dione
CID 88268129

Frequently Asked Questions

What is the IUPAC name of 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione (CID 43259678) is 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione is Nc1ccc(=O)n(CCCN2C(=O)CNC2=O)c1.
What is the InChIKey of 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione?
The InChIKey is RLLQNGIVQKMTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O3/c12-8-2-3-9(16)14(7-8)4-1-5-15-10(17)6-13-11(15)18/h2-3,7H,1,4-6,12H2,(H,13,18).
What are the key properties of 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione?
3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione has a molecular weight of 250.26 g/mol, XLogP of -0.63, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(5-amino-2-oxo-1-pyridinyl)propyl]imidazolidine-2,4-dione is sourced from PubChem (CID 43259678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).