1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one

C13H19N3O2 — CID 55158270

IUPAC1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCNC(CO)c1ccccc1
InChIInChI=1S/C13H19N3O2/c17-10-12(11-4-2-1-3-5-11)14-6-8-16-9-7-15-13(16)18/h1-5,12,14,17H,6-10H2,(H,15,18)
InChIKeyJMHWVUIBMKWGHQ-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.33
Rot. Bonds6

About 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one

1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one (PubChem CID 55158270) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one
PubChem CID55158270
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCNC(CO)c1ccccc1
InChIInChI=1S/C13H19N3O2/c17-10-12(11-4-2-1-3-5-11)14-6-8-16-9-7-15-13(16)18/h1-5,12,14,17H,6-10H2,(H,15,18)
InChIKeyJMHWVUIBMKWGHQ-UHFFFAOYSA-N
XLogP0.33
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(1,3-dihydroxypropan-2-ylamino)ethyl]imidazolidin-2-one
CID 65313305
1-(2-anilinoethyl)imidazolidin-2-one
CID 28565231
1-[2-(1-thiophen-2-ylpropylamino)ethyl]imidazolidin-2-one
CID 54964422
3-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-phenylpropanamide
CID 46996236
1-[2-[[(1R)-1-pyridin-2-ylethyl]amino]ethyl]imidazolidin-2-one
CID 81406832
1-[2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]ethyl]imidazolidin-2-one
CID 81353835
1-[2-[[(2R)-2-hydroxy-2-phenylethyl]-[(2S)-2-hydroxy-2-phenylethyl]amino]ethyl]imidazolidin-2-one
CID 7189333
1-(2-hydroxy-1-phenylethyl)imidazolidin-2-one
CID 112756247
1-[(1R)-2-hydroxy-1-phenylethyl]imidazolidin-2-one
CID 107863748
(2R)-2-(but-3-enylamino)-2-phenylethanol
CID 14716014
1-(3-oxo-3-phenylpropyl)imidazolidin-2-one
CID 11183562
4-[(2-hydroxy-1-phenylethyl)amino]butan-1-ol
CID 63183327

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one (CID 55158270) is 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one is O=C1NCCN1CCNC(CO)c1ccccc1.
What is the InChIKey of 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one?
The InChIKey is JMHWVUIBMKWGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c17-10-12(11-4-2-1-3-5-11)14-6-8-16-9-7-15-13(16)18/h1-5,12,14,17H,6-10H2,(H,15,18).
What are the key properties of 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one?
1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one has a molecular weight of 249.31 g/mol, XLogP of 0.33, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-hydroxy-1-phenylethyl)amino]ethyl]imidazolidin-2-one is sourced from PubChem (CID 55158270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).