4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one

C12H16N2O2 — CID 66713277

IUPAC4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one
SMILESC[C@H](c1ccccc1)N1CC(CO)NC1=O
InChIInChI=1S/C12H16N2O2/c1-9(10-5-3-2-4-6-10)14-7-11(8-15)13-12(14)16/h2-6,9,11,15H,7-8H2,1H3,(H,13,16)/t9-,11?/m1/s1
InChIKeyGSVBUPAJIKDATB-BFHBGLAWSA-N
MW220.27 g/mol
LogP1.13
Rot. Bonds3

About 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one

4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one (PubChem CID 66713277) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one.

Molecular Properties

Compound Name4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one
PubChem CID66713277
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one
SMILESC[C@H](c1ccccc1)N1CC(CO)NC1=O
InChIInChI=1S/C12H16N2O2/c1-9(10-5-3-2-4-6-10)14-7-11(8-15)13-12(14)16/h2-6,9,11,15H,7-8H2,1H3,(H,13,16)/t9-,11?/m1/s1
InChIKeyGSVBUPAJIKDATB-BFHBGLAWSA-N
XLogP1.13
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 117026726
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CID 118420929
3-hydroxy-1-[(1R)-1-phenylethyl]-4-propan-2-ylpyrrolidin-2-one
CID 58335409
3-(hydroxymethyl)-1-(1-phenylethyl)-4-prop-2-enylpyrrolidin-2-one
CID 143715115
3-methyl-1-[(1R)-1-phenylethyl]pyrrolidin-2-one
CID 142649009
(2R)-5,6-dioxo-4-[(1R)-1-phenylethyl]piperazine-2-carboxylic acid
CID 142671782
4-(1-phenylethyl)-1-propan-2-ylimidazolidin-2-one
CID 176750424
4-methyl-1-[(1S)-1-phenylethyl]piperidin-2-one
CID 53382448
(4R)-4-(cyclobutanecarbonyl)-1-[(1R)-1-phenylethyl]pyrrolidin-2-one
CID 21087447
4-(2-hydroxyethyl)-1-[1-(4-methoxyphenyl)ethyl]-1,3-diazinan-2-one
CID 143803089
4-(4-hydroxy-2-methylbutyl)-1-[(1S)-1-phenylethyl]pyrrolidin-2-one
CID 68806012
(4R)-4-hydroxy-3,3-dimethyl-1-[(1R)-1-phenylethyl]pyrrolidin-2-one
CID 99770501

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one?
The IUPAC name of 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one (CID 66713277) is 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one.
What is the SMILES notation for 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one?
The canonical SMILES for 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one is C[C@H](c1ccccc1)N1CC(CO)NC1=O.
What is the InChIKey of 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one?
The InChIKey is GSVBUPAJIKDATB-BFHBGLAWSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-9(10-5-3-2-4-6-10)14-7-11(8-15)13-12(14)16/h2-6,9,11,15H,7-8H2,1H3,(H,13,16)/t9-,11?/m1/s1.
What are the key properties of 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one?
4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one has a molecular weight of 220.27 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-1-[(1R)-1-phenylethyl]imidazolidin-2-one is sourced from PubChem (CID 66713277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).