N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide

C12H14N4O3 — CID 20540544

IUPACN-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide
SMILESNC(=O)C(NC(=O)N1CCNC1=O)c1ccccc1
InChIInChI=1S/C12H14N4O3/c13-10(17)9(8-4-2-1-3-5-8)15-12(19)16-7-6-14-11(16)18/h1-5,9H,6-7H2,(H2,13,17)(H,14,18)(H,15,19)
InChIKeyWRFOQYJBSHXMAE-UHFFFAOYSA-N
MW262.27 g/mol
LogP-0.05
Rot. Bonds3

About N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide

N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide (PubChem CID 20540544) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide
PubChem CID20540544
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC NameN-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide
SMILESNC(=O)C(NC(=O)N1CCNC1=O)c1ccccc1
InChIInChI=1S/C12H14N4O3/c13-10(17)9(8-4-2-1-3-5-8)15-12(19)16-7-6-14-11(16)18/h1-5,9H,6-7H2,(H2,13,17)(H,14,18)(H,15,19)
InChIKeyWRFOQYJBSHXMAE-UHFFFAOYSA-N
XLogP-0.05
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-oxo-1-phenylethyl)-4-ethyl-2,3-dioxopiperazine-1-carboxamide
CID 19833690
(2R,5R,6S)-3,3-dimethyl-7-oxo-6-[[2-[(2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CID 24847914
(6S,7R)-3-methyl-8-oxo-7-[[(2R)-2-[(2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CID 7034774
(2S,5R,6R)-6-[acetyl-[(2R)-2-[(2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CID 170456170
2-oxo-N-pyridin-2-ylimidazolidine-1-carboxamide
CID 679208
sodium;(2S,5R,6R)-6-formamido-3,3-dimethyl-7-oxo-6-[[2-[(2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;hydride
CID 173393379
2-(4-methylthiophen-2-yl)-2-[(2-oxoimidazolidine-1-carbonyl)amino]acetic acid
CID 154425816
trans-(1R,2R)-N-[(1S)-2-amino-2-oxo-1-phenylethyl]-2-piperazin-1-ylcyclohexane-1-carboxamide;trans-(1S,2S)-N-[(1S)-2-amino-2-oxo-1-phenylethyl]-2-piperazin-1-ylcyclohexane-1-carboxamide
CID 159017930
(2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetate
CID 7157273
2-ethoxycarbonyloxyethyl (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-[(2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CID 70580595
2-[(2-oxo-2-phenylacetyl)amino]-2-phenylacetamide
CID 13258038
2-(chloroamino)-2-phenylacetamide
CID 89152727

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide (CID 20540544) is N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide is NC(=O)C(NC(=O)N1CCNC1=O)c1ccccc1.
What is the InChIKey of N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide?
The InChIKey is WRFOQYJBSHXMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3/c13-10(17)9(8-4-2-1-3-5-8)15-12(19)16-7-6-14-11(16)18/h1-5,9H,6-7H2,(H2,13,17)(H,14,18)(H,15,19).
What are the key properties of N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide?
N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide has a molecular weight of 262.27 g/mol, XLogP of -0.05, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxo-1-phenylethyl)-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 20540544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).