3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one

C14H18N2O — CID 83244563

IUPAC3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one
SMILESO=C1C(c2ccccc2)NCN1CC1CCC1
InChIInChI=1S/C14H18N2O/c17-14-13(12-7-2-1-3-8-12)15-10-16(14)9-11-5-4-6-11/h1-3,7-8,11,13,15H,4-6,9-10H2
InChIKeyMLCKQJBRTCITKN-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.92
Rot. Bonds3

About 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one

3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one (PubChem CID 83244563) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one.

Molecular Properties

Compound Name3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one
PubChem CID83244563
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one
SMILESO=C1C(c2ccccc2)NCN1CC1CCC1
InChIInChI=1S/C14H18N2O/c17-14-13(12-7-2-1-3-8-12)15-10-16(14)9-11-5-4-6-11/h1-3,7-8,11,13,15H,4-6,9-10H2
InChIKeyMLCKQJBRTCITKN-UHFFFAOYSA-N
XLogP1.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one?
The IUPAC name of 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one (CID 83244563) is 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one.
What is the SMILES notation for 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one?
The canonical SMILES for 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one is O=C1C(c2ccccc2)NCN1CC1CCC1.
What is the InChIKey of 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one?
The InChIKey is MLCKQJBRTCITKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c17-14-13(12-7-2-1-3-8-12)15-10-16(14)9-11-5-4-6-11/h1-3,7-8,11,13,15H,4-6,9-10H2.
What are the key properties of 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one?
3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one has a molecular weight of 230.31 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethyl)-5-phenylimidazolidin-4-one is sourced from PubChem (CID 83244563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).