2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide

C11H12N4O3 — CID 84571871

IUPAC2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide
SMILESNNC(=O)CN1C(=O)NC(c2ccccc2)C1=O
InChIInChI=1S/C11H12N4O3/c12-14-8(16)6-15-10(17)9(13-11(15)18)7-4-2-1-3-5-7/h1-5,9H,6,12H2,(H,13,18)(H,14,16)
InChIKeyFULFAEHMSOOYQY-UHFFFAOYSA-N
MW248.24 g/mol
LogP-0.73
Rot. Bonds3

About 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide

2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide (PubChem CID 84571871) has the molecular formula C11H12N4O3 and a molecular weight of 248.24 g/mol. Its IUPAC name is 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide.

Molecular Properties

Compound Name2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide
PubChem CID84571871
Molecular FormulaC11H12N4O3
Molecular Weight248.24 g/mol
Exact Mass248.09
IUPAC Name2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide
SMILESNNC(=O)CN1C(=O)NC(c2ccccc2)C1=O
InChIInChI=1S/C11H12N4O3/c12-14-8(16)6-15-10(17)9(13-11(15)18)7-4-2-1-3-5-7/h1-5,9H,6,12H2,(H,13,18)(H,14,16)
InChIKeyFULFAEHMSOOYQY-UHFFFAOYSA-N
XLogP-0.73
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 5-0.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571944
N-(4-anilinophenyl)-2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571858
N-(4-chlorophenyl)-2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571668
butyl 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetate
CID 84572142
N-(2,5-dichlorophenyl)-2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571692
2-(2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-nitrophenyl)acetamide
CID 84571824
tert-butyl 2-[(4R)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetate
CID 125482450
N-(4-chloro-2-methylphenyl)-2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571672
3-ethyl-5-phenylimidazolidine-2,4-dione
CID 3292
3-ethyl-5-phenylimidazolidine-2,4-dione;hydrochloride
CID 140541909
ethyl 2-[2-[[2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-1,3-thiazol-4-yl]acetate
CID 84571978
3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
CID 84571226

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide?
The IUPAC name of 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide (CID 84571871) is 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide.
What is the SMILES notation for 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide?
The canonical SMILES for 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide is NNC(=O)CN1C(=O)NC(c2ccccc2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide?
The InChIKey is FULFAEHMSOOYQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3/c12-14-8(16)6-15-10(17)9(13-11(15)18)7-4-2-1-3-5-7/h1-5,9H,6,12H2,(H,13,18)(H,14,16).
What are the key properties of 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide?
2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide has a molecular weight of 248.24 g/mol, XLogP of -0.73, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide is sourced from PubChem (CID 84571871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).