1-(2-butan-2-ylphenyl)imidazolidin-2-one

C13H18N2O — CID 115370483

IUPAC1-(2-butan-2-ylphenyl)imidazolidin-2-one
SMILESCCC(C)c1ccccc1N1CCNC1=O
InChIInChI=1S/C13H18N2O/c1-3-10(2)11-6-4-5-7-12(11)15-9-8-14-13(15)16/h4-7,10H,3,8-9H2,1-2H3,(H,14,16)
InChIKeyBAXNVFDUQPEWNM-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.73
Rot. Bonds3

About 1-(2-butan-2-ylphenyl)imidazolidin-2-one

1-(2-butan-2-ylphenyl)imidazolidin-2-one (PubChem CID 115370483) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-(2-butan-2-ylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-butan-2-ylphenyl)imidazolidin-2-one
PubChem CID115370483
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-(2-butan-2-ylphenyl)imidazolidin-2-one
SMILESCCC(C)c1ccccc1N1CCNC1=O
InChIInChI=1S/C13H18N2O/c1-3-10(2)11-6-4-5-7-12(11)15-9-8-14-13(15)16/h4-7,10H,3,8-9H2,1-2H3,(H,14,16)
InChIKeyBAXNVFDUQPEWNM-UHFFFAOYSA-N
XLogP2.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2-butan-2-ylphenyl)imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-[1-(ethylamino)ethyl]phenyl]imidazolidin-2-one
CID 65295461
1-(2-methylsulfanylphenyl)imidazolidin-2-one
CID 107647362
1-(2-butan-2-ylphenyl)piperidin-4-one
CID 131843613
1-[2-[1-(methylamino)ethyl]phenyl]-1,3-diazinan-2-one
CID 65295411
1-naphthalen-1-ylimidazolidin-2-one
CID 70078556
8-(2-butan-2-ylphenyl)-8-azabicyclo[3.2.1]octan-3-one
CID 62739265
1-[2-(dimethylamino)phenyl]imidazolidin-2-one
CID 106761145
9-(2-butan-2-ylphenyl)-9-azabicyclo[3.3.1]nonan-3-one
CID 62714115
4-[2-(1-hydroxypropan-2-yl)phenyl]piperazin-2-one
CID 117340762
(3R)-1-[2-[(2R)-butan-2-yl]phenyl]-5-oxopyrrolidine-3-carboxylate
CID 2442336
1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one
CID 115370438
1-[2-(difluoromethoxy)phenyl]imidazolidin-2-one
CID 115370453

Frequently Asked Questions

What is the IUPAC name of 1-(2-butan-2-ylphenyl)imidazolidin-2-one?
The IUPAC name of 1-(2-butan-2-ylphenyl)imidazolidin-2-one (CID 115370483) is 1-(2-butan-2-ylphenyl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-butan-2-ylphenyl)imidazolidin-2-one?
The canonical SMILES for 1-(2-butan-2-ylphenyl)imidazolidin-2-one is CCC(C)c1ccccc1N1CCNC1=O.
What is the InChIKey of 1-(2-butan-2-ylphenyl)imidazolidin-2-one?
The InChIKey is BAXNVFDUQPEWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-3-10(2)11-6-4-5-7-12(11)15-9-8-14-13(15)16/h4-7,10H,3,8-9H2,1-2H3,(H,14,16).
What are the key properties of 1-(2-butan-2-ylphenyl)imidazolidin-2-one?
1-(2-butan-2-ylphenyl)imidazolidin-2-one has a molecular weight of 218.30 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-butan-2-ylphenyl)imidazolidin-2-one is sourced from PubChem (CID 115370483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).