1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one

C14H20N2O — CID 20685332

IUPAC1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one
SMILESCC1C(c2ccccc2)N(C(C)C)C(=O)N1C
InChIInChI=1S/C14H20N2O/c1-10(2)16-13(11(3)15(4)14(16)17)12-8-6-5-7-9-12/h5-11,13H,1-4H3
InChIKeyVCBHNATZVWQYSY-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.89
Rot. Bonds2

About 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one

1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one (PubChem CID 20685332) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one
PubChem CID20685332
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one
SMILESCC1C(c2ccccc2)N(C(C)C)C(=O)N1C
InChIInChI=1S/C14H20N2O/c1-10(2)16-13(11(3)15(4)14(16)17)12-8-6-5-7-9-12/h5-11,13H,1-4H3
InChIKeyVCBHNATZVWQYSY-UHFFFAOYSA-N
XLogP2.89
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one?
The IUPAC name of 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one (CID 20685332) is 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one.
What is the SMILES notation for 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one?
The canonical SMILES for 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one is CC1C(c2ccccc2)N(C(C)C)C(=O)N1C.
What is the InChIKey of 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one?
The InChIKey is VCBHNATZVWQYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10(2)16-13(11(3)15(4)14(16)17)12-8-6-5-7-9-12/h5-11,13H,1-4H3.
What are the key properties of 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one?
1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one has a molecular weight of 232.33 g/mol, XLogP of 2.89, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one is sourced from PubChem (CID 20685332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).