1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one

C15H22N2O2 — CID 117410772

IUPAC1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
SMILESCC(CO)c1ccc(N2CCN(C(C)C)C2=O)cc1
InChIInChI=1S/C15H22N2O2/c1-11(2)16-8-9-17(15(16)19)14-6-4-13(5-7-14)12(3)10-18/h4-7,11-12,18H,8-10H2,1-3H3
InChIKeyBLPGENZROOAXOZ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.43
Rot. Bonds4

About 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one

1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one (PubChem CID 117410772) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
PubChem CID117410772
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
SMILESCC(CO)c1ccc(N2CCN(C(C)C)C2=O)cc1
InChIInChI=1S/C15H22N2O2/c1-11(2)16-8-9-17(15(16)19)14-6-4-13(5-7-14)12(3)10-18/h4-7,11-12,18H,8-10H2,1-3H3
InChIKeyBLPGENZROOAXOZ-UHFFFAOYSA-N
XLogP2.43
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-3-propan-2-ylimidazolidin-2-one
CID 129202932
1-[4-(2-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117410785
3-methyl-3-[4-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]butanoic acid
CID 117489746
1-[3-(1-aminoethyl)phenyl]-3-propan-2-ylimidazolidin-2-one
CID 117371582
1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazol-2-one
CID 117405223
4-[4-(1-hydroxypropan-2-yl)phenyl]-1-methylpiperazine-2,6-dione
CID 117410361
1-[4-(4-aminobutan-2-yl)phenyl]-3-methylimidazolidin-2-one
CID 117371623
3-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]butanal
CID 117438638
2-amino-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetic acid
CID 117444231
2-(4-imidazol-1-ylphenyl)propan-1-ol
CID 117290878
methyl 2-hydroxy-2-[3-(2-oxo-3-propan-2-ylimidazolidin-1-yl)phenyl]acetate
CID 117472059
1-methyl-3-propan-2-ylimidazolidin-2-one
CID 14177967

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The IUPAC name of 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one (CID 117410772) is 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The canonical SMILES for 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one is CC(CO)c1ccc(N2CCN(C(C)C)C2=O)cc1.
What is the InChIKey of 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
The InChIKey is BLPGENZROOAXOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(2)16-8-9-17(15(16)19)14-6-4-13(5-7-14)12(3)10-18/h4-7,11-12,18H,8-10H2,1-3H3.
What are the key properties of 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one?
1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one has a molecular weight of 262.35 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-hydroxypropan-2-yl)phenyl]-3-propan-2-ylimidazolidin-2-one is sourced from PubChem (CID 117410772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).