(4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide

C13H17N3O3 — CID 97062692

IUPAC(4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide
SMILESCO[C@@H](CNC(=O)[C@@H]1CNC(=O)N1)c1ccccc1
InChIInChI=1S/C13H17N3O3/c1-19-11(9-5-3-2-4-6-9)8-14-12(17)10-7-15-13(18)16-10/h2-6,10-11H,7-8H2,1H3,(H,14,17)(H2,15,16,18)/t10-,11-/m0/s1
InChIKeyUAHWOUMRQOHUPE-QWRGUYRKSA-N
MW263.30 g/mol
LogP0.17
Rot. Bonds5

About (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide

(4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide (PubChem CID 97062692) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide.

Molecular Properties

Compound Name(4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide
PubChem CID97062692
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name(4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide
SMILESCO[C@@H](CNC(=O)[C@@H]1CNC(=O)N1)c1ccccc1
InChIInChI=1S/C13H17N3O3/c1-19-11(9-5-3-2-4-6-9)8-14-12(17)10-7-15-13(18)16-10/h2-6,10-11H,7-8H2,1H3,(H,14,17)(H2,15,16,18)/t10-,11-/m0/s1
InChIKeyUAHWOUMRQOHUPE-QWRGUYRKSA-N
XLogP0.17
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N-(2-methoxy-2-phenylethyl)pyrrolidine-2-carboxamide
CID 119703911
N-(2-methoxy-2-phenylethyl)piperidine-2-carboxamide;hydrochloride
CID 119278882
(2S,4R)-4-hydroxy-N-[(2S)-2-methoxy-2-phenylethyl]pyrrolidine-2-carboxamide
CID 125135014
(4R)-2-oxo-N-[3-[(1S)-1-phenylethoxy]propyl]imidazolidine-4-carboxamide
CID 97089035
N-(2-methoxy-2-phenylethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;hydrochloride
CID 119278884
(4S)-N-[(2R)-2-hydroxypropyl]-2-oxoimidazolidine-4-carboxamide
CID 131209001
(4S)-N-[(2S)-2-(1H-indol-3-yl)-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide
CID 97081227
(4R)-N-[(R)-cyclopentyl(phenyl)methyl]-2-oxoimidazolidine-4-carboxamide
CID 97081118
(2R)-2-ethyl-N-[(2S)-2-methoxy-2-phenylethyl]-3-oxopiperazine-1-carboxamide
CID 95759828
(2S,5R)-5-(aminomethyl)-N-(2-methoxy-2-phenylethyl)oxolane-2-carboxamide;hydrochloride
CID 120785607
(4S)-N-[(R)-(4-chlorophenyl)-phenylmethyl]-2-oxoimidazolidine-4-carboxamide
CID 97081299
N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-2-oxoimidazolidine-4-carboxamide
CID 71877790

Frequently Asked Questions

What is the IUPAC name of (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide?
The IUPAC name of (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide (CID 97062692) is (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide.
What is the SMILES notation for (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide?
The canonical SMILES for (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide is CO[C@@H](CNC(=O)[C@@H]1CNC(=O)N1)c1ccccc1.
What is the InChIKey of (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide?
The InChIKey is UAHWOUMRQOHUPE-QWRGUYRKSA-N. The full InChI is InChI=1S/C13H17N3O3/c1-19-11(9-5-3-2-4-6-9)8-14-12(17)10-7-15-13(18)16-10/h2-6,10-11H,7-8H2,1H3,(H,14,17)(H2,15,16,18)/t10-,11-/m0/s1.
What are the key properties of (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide?
(4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 0.17, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-[(2R)-2-methoxy-2-phenylethyl]-2-oxoimidazolidine-4-carboxamide is sourced from PubChem (CID 97062692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).