3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione

C14H18N2O2 — CID 60585647

IUPAC3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
SMILESCC(C)c1ccc(C2(C)NC(=O)N(C)C2=O)cc1
InChIInChI=1S/C14H18N2O2/c1-9(2)10-5-7-11(8-6-10)14(3)12(17)16(4)13(18)15-14/h5-9H,1-4H3,(H,15,18)
InChIKeyCGHHVTQOBULBBN-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.21
Rot. Bonds2

About 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione

3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione (PubChem CID 60585647) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
PubChem CID60585647
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
SMILESCC(C)c1ccc(C2(C)NC(=O)N(C)C2=O)cc1
InChIInChI=1S/C14H18N2O2/c1-9(2)10-5-7-11(8-6-10)14(3)12(17)16(4)13(18)15-14/h5-9H,1-4H3,(H,15,18)
InChIKeyCGHHVTQOBULBBN-UHFFFAOYSA-N
XLogP2.21
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-(aminomethyl)-3-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
CID 82302224
2-[(4S)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]acetic acid
CID 30054775
(5S)-3,5-dimethyl-5-[4-(2-methylpropoxy)phenyl]imidazolidine-2,4-dione
CID 838462
(5R)-5-methyl-3-(3-oxobutyl)-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
CID 7571644
3,5-dimethyl-5-[4-(3-methylbutoxy)phenyl]imidazolidine-2,4-dione
CID 2835308
(5R)-3,5-dimethyl-5-[4-(3-methylbutoxy)phenyl]imidazolidine-2,4-dione
CID 691223
3-[2-(azetidin-1-yl)-2-oxoethyl]-5-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
CID 43071602
(5R)-5-methyl-3-(2-oxo-2-piperidin-1-ylethyl)-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
CID 7802517
(5R)-3-[(4-tert-butylphenyl)methyl]-5-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
CID 7595987
(5R)-3-[2-(2,6-dichlorophenoxy)ethyl]-5-methyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione
CID 7596048
N-[(2S)-3-methylbutan-2-yl]-2-[(4S)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]acetamide
CID 7802579
N,N-diethyl-2-[(4R)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]acetamide
CID 7595916

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione (CID 60585647) is 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione is CC(C)c1ccc(C2(C)NC(=O)N(C)C2=O)cc1.
What is the InChIKey of 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
The InChIKey is CGHHVTQOBULBBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-9(2)10-5-7-11(8-6-10)14(3)12(17)16(4)13(18)15-14/h5-9H,1-4H3,(H,15,18).
What are the key properties of 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione?
3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione has a molecular weight of 246.31 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-5-(4-propan-2-ylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 60585647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).