3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione

C15H18N4O3 — CID 14230005

IUPAC3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione
SMILESCC(C)CN1C(=O)N(C)C2(NC(=O)NC2=O)c2ccccc21
InChIInChI=1S/C15H18N4O3/c1-9(2)8-19-11-7-5-4-6-10(11)15(18(3)14(19)22)12(20)16-13(21)17-15/h4-7,9H,8H2,1-3H3,(H2,16,17,20,21)
InChIKeyMEEAGEYPHIGODW-UHFFFAOYSA-N
MW302.33 g/mol
LogP1.21
Rot. Bonds2

About 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione

3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione (PubChem CID 14230005) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione.

Molecular Properties

Compound Name3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione
PubChem CID14230005
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC Name3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione
SMILESCC(C)CN1C(=O)N(C)C2(NC(=O)NC2=O)c2ccccc21
InChIInChI=1S/C15H18N4O3/c1-9(2)8-19-11-7-5-4-6-10(11)15(18(3)14(19)22)12(20)16-13(21)17-15/h4-7,9H,8H2,1-3H3,(H2,16,17,20,21)
InChIKeyMEEAGEYPHIGODW-UHFFFAOYSA-N
XLogP1.21
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.21
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

3-Propyl-1,2,3,4-tetrahydroquinazoline-2,4-dione
CID 4344644
3-ethylquinazoline-2,4(1H,3H)-dione
CID 747439
1-[2-(3,4-Dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]-pyrrolidine-2,5-dione
CID 775593
2-{3-[4-(2-methylphenyl)-1-piperazinyl]propyl}tetrahydroimidazo[1,5-a]pyridine-1,3(2H,5H)-dione
CID 10571215
3-Butyl-2-hydroxyquinazolin-4(3h)-one
CID 246265
N-benzoyl-3,4-dihydro-2H-quinoline-1-carboxamide
CID 2160596
3-[2-(2-oxo-1-imidazolidinyl)ethyl]-2-phenyl-2,3-dihydro-4(1H)-quinazolinone
CID 2813225
2-(4-Methylphenyl)-3-[2-(2-oxoimidazolidin-1-yl)ethyl]-1,2-dihydroquinazolin-4-one
CID 2815279
N-Cyclohexyl-2-(3-ethyl-2,4-dioxo-3,4-dihydro-2H-quinazolin-1-yl)-acetamide
CID 6502162
N-(2-Cyclohex-1-enyl-ethyl)-2-(3-methyl-2,4-dioxo-3,4-dihydro-2H-quinazolin-1-yl)-acetamide
CID 6502430
(10aS)-2-(2-ethylphenyl)-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione
CID 7714690
1-[2-[(2,4-Dimethylphenyl)carbamoylamino]-2-oxoethyl]piperidine-4-carboxamide
CID 9505890

Frequently Asked Questions

What is the IUPAC name of 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione?
The IUPAC name of 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione (CID 14230005) is 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione.
What is the SMILES notation for 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione?
The canonical SMILES for 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione is CC(C)CN1C(=O)N(C)C2(NC(=O)NC2=O)c2ccccc21.
What is the InChIKey of 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione?
The InChIKey is MEEAGEYPHIGODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3/c1-9(2)8-19-11-7-5-4-6-10(11)15(18(3)14(19)22)12(20)16-13(21)17-15/h4-7,9H,8H2,1-3H3,(H2,16,17,20,21).
What are the key properties of 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione?
3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione has a molecular weight of 302.33 g/mol, XLogP of 1.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-methyl-1'-(2-methylpropyl)spiro[imidazolidine-5,4'-quinazoline]-2,2',4-trione is sourced from PubChem (CID 14230005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).