3-methyl-5-(2-phenylethyl)imidazolidin-4-one

C12H16N2O — CID 18720114

IUPAC3-methyl-5-(2-phenylethyl)imidazolidin-4-one
SMILESCN1CNC(CCc2ccccc2)C1=O
InChIInChI=1S/C12H16N2O/c1-14-9-13-11(12(14)15)8-7-10-5-3-2-4-6-10/h2-6,11,13H,7-9H2,1H3
InChIKeyKBCUMPJCMMBZDO-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.01
Rot. Bonds3

About 3-methyl-5-(2-phenylethyl)imidazolidin-4-one

3-methyl-5-(2-phenylethyl)imidazolidin-4-one (PubChem CID 18720114) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 3-methyl-5-(2-phenylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-methyl-5-(2-phenylethyl)imidazolidin-4-one
PubChem CID18720114
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name3-methyl-5-(2-phenylethyl)imidazolidin-4-one
SMILESCN1CNC(CCc2ccccc2)C1=O
InChIInChI=1S/C12H16N2O/c1-14-9-13-11(12(14)15)8-7-10-5-3-2-4-6-10/h2-6,11,13H,7-9H2,1H3
InChIKeyKBCUMPJCMMBZDO-UHFFFAOYSA-N
XLogP1.01
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[4-(dimethylamino)butyl]-5-(2-phenylethyl)imidazolidin-4-one
CID 114923850
3-cyclopentyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114921872
3-(2-methylpentan-3-yl)-5-(2-phenylethyl)imidazolidin-4-one
CID 114923519
(5S)-3-methyl-5-(naphthalen-2-ylmethyl)imidazolidin-4-one
CID 59884171
1-methyl-3-(2-phenylethyl)pyrrolidin-2-one
CID 24974613
3-(7-oxabicyclo[2.2.1]heptan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one
CID 114927820
2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one
CID 114921936
actinium;(5S)-5-[(4-hydroxyphenyl)methyl]-3-methylimidazolidin-4-one
CID 59883958
(5S)-5-[(4-methoxyphenyl)methyl]-3-methylimidazolidin-4-one
CID 59883960
(5R)-3-(2-methylsulfonylethyl)-5-(2-phenylethyl)imidazolidine-2,4-dione
CID 95582364
(5S)-5-[(3,5-difluorophenyl)methyl]-3-methylimidazolidin-4-one
CID 59884194
1-methyl-5-(2-phenylethyl)-1,3-diazinane-2,4,6-trione
CID 67491873

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(2-phenylethyl)imidazolidin-4-one?
The IUPAC name of 3-methyl-5-(2-phenylethyl)imidazolidin-4-one (CID 18720114) is 3-methyl-5-(2-phenylethyl)imidazolidin-4-one.
What is the SMILES notation for 3-methyl-5-(2-phenylethyl)imidazolidin-4-one?
The canonical SMILES for 3-methyl-5-(2-phenylethyl)imidazolidin-4-one is CN1CNC(CCc2ccccc2)C1=O.
What is the InChIKey of 3-methyl-5-(2-phenylethyl)imidazolidin-4-one?
The InChIKey is KBCUMPJCMMBZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-14-9-13-11(12(14)15)8-7-10-5-3-2-4-6-10/h2-6,11,13H,7-9H2,1H3.
What are the key properties of 3-methyl-5-(2-phenylethyl)imidazolidin-4-one?
3-methyl-5-(2-phenylethyl)imidazolidin-4-one has a molecular weight of 204.27 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(2-phenylethyl)imidazolidin-4-one is sourced from PubChem (CID 18720114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).