1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one

C16H24N2O2 — CID 62490490

IUPAC1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one
SMILESCC(C)Cc1ccc(C(O)CN2CCN(C)C2=O)cc1
InChIInChI=1S/C16H24N2O2/c1-12(2)10-13-4-6-14(7-5-13)15(19)11-18-9-8-17(3)16(18)20/h4-7,12,15,19H,8-11H2,1-3H3
InChIKeyKCKYDRAXCXXOJB-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.29
Rot. Bonds5

About 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one

1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one (PubChem CID 62490490) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one
PubChem CID62490490
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one
SMILESCC(C)Cc1ccc(C(O)CN2CCN(C)C2=O)cc1
InChIInChI=1S/C16H24N2O2/c1-12(2)10-13-4-6-14(7-5-13)15(19)11-18-9-8-17(3)16(18)20/h4-7,12,15,19H,8-11H2,1-3H3
InChIKeyKCKYDRAXCXXOJB-UHFFFAOYSA-N
XLogP2.29
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-3-[2-(methylamino)-2-[4-(2-methylpropyl)phenyl]ethyl]imidazolidin-2-one
CID 62491482
1-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]-3-methylimidazolidin-2-one
CID 62492213
4-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]morpholin-3-one
CID 79467881
1-[2-hydroxy-2-(4-propoxyphenyl)ethyl]-3-methylimidazolidin-2-one
CID 62492041
1-[4-(2-methylpropyl)phenyl]-3-pyrrolidin-1-ylpropan-1-ol
CID 112510765
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 115561346
2-(3-methylpiperidin-1-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 60981654
3-ethyl-1-[4-(2-methylpropyl)phenyl]pentan-1-ol
CID 82928091
2-(2,2-dimethylmorpholin-4-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 60981558
1-[2-hydroxy-3-(methylamino)propyl]-3-methylimidazolidin-2-one
CID 62492375
1-[2-amino-2-[4-(trifluoromethyl)phenyl]ethyl]-3-methylimidazolidin-2-one
CID 107522455
3-(3-methyl-2-oxoimidazolidin-1-yl)-2-phenylpropanethioamide
CID 64535741

Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one?
The IUPAC name of 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one (CID 62490490) is 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one?
The canonical SMILES for 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one is CC(C)Cc1ccc(C(O)CN2CCN(C)C2=O)cc1.
What is the InChIKey of 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one?
The InChIKey is KCKYDRAXCXXOJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(2)10-13-4-6-14(7-5-13)15(19)11-18-9-8-17(3)16(18)20/h4-7,12,15,19H,8-11H2,1-3H3.
What are the key properties of 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one?
1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one has a molecular weight of 276.38 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]-3-methylimidazolidin-2-one is sourced from PubChem (CID 62490490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).