1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea

C20H24N2O3 — CID 124505433

IUPAC1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea
SMILESO=C(NC[C@@H]1CCO[C@H]1c1ccccc1)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C20H24N2O3/c23-14-18(15-7-3-1-4-8-15)22-20(24)21-13-17-11-12-25-19(17)16-9-5-2-6-10-16/h1-10,17-19,23H,11-14H2,(H2,21,22,24)/t17-,18-,19-/m0/s1
InChIKeyFCUDWWXTBRNQAN-FHWLQOOXSA-N
MW340.42 g/mol
LogP2.80
Rot. Bonds6

About 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea

1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea (PubChem CID 124505433) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea.

Molecular Properties

Compound Name1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea
PubChem CID124505433
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea
SMILESO=C(NC[C@@H]1CCO[C@H]1c1ccccc1)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C20H24N2O3/c23-14-18(15-7-3-1-4-8-15)22-20(24)21-13-17-11-12-25-19(17)16-9-5-2-6-10-16/h1-10,17-19,23H,11-14H2,(H2,21,22,24)/t17-,18-,19-/m0/s1
InChIKeyFCUDWWXTBRNQAN-FHWLQOOXSA-N
XLogP2.80
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea with MolForge

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Related Compounds

1-[(1S)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea
CID 124622593
1-[(2R)-3-methylbutan-2-yl]-3-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]urea
CID 129331695
1-[(2-tert-butyloxan-3-yl)methyl]-3-(2-hydroxy-1-phenylethyl)urea
CID 111428448
1-[[(1R,2R)-2-methylcyclopropyl]methyl]-3-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]urea
CID 129336295
1-[2-(hydroxymethyl)cyclohexyl]-3-[(2-phenyloxolan-3-yl)methyl]urea
CID 71864345
1-[[(2R,3R)-2-phenyloxan-3-yl]methyl]-3-[(1S)-1-pyridin-3-ylethyl]urea
CID 124832309
1-(1,2-oxazol-3-ylmethyl)-3-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]urea
CID 129000845
1-(3-hydroxy-2-phenylpropyl)-2-methyl-3-[(2-phenyloxolan-3-yl)methyl]guanidine
CID 109408633
cis-(1S,2R)-2-[[(2R,3S)-2-phenyloxolan-3-yl]methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 129402634
N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]-2-pyrrol-1-ylpropanamide
CID 129004071
N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]-2-pyridin-3-ylpropanamide
CID 129002179
3-fluoro-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]pyridine-4-carboxamide
CID 129002144

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea?
The IUPAC name of 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea (CID 124505433) is 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea.
What is the SMILES notation for 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea?
The canonical SMILES for 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea is O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)N[C@@H](CO)c1ccccc1.
What is the InChIKey of 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea?
The InChIKey is FCUDWWXTBRNQAN-FHWLQOOXSA-N. The full InChI is InChI=1S/C20H24N2O3/c23-14-18(15-7-3-1-4-8-15)22-20(24)21-13-17-11-12-25-19(17)16-9-5-2-6-10-16/h1-10,17-19,23H,11-14H2,(H2,21,22,24)/t17-,18-,19-/m0/s1.
What are the key properties of 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea?
1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea has a molecular weight of 340.42 g/mol, XLogP of 2.80, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-hydroxy-1-phenylethyl]-3-[[(2R,3S)-2-phenyloxolan-3-yl]methyl]urea is sourced from PubChem (CID 124505433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).