2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide

C13H17N5O3 — CID 60707218

IUPAC2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide
SMILESCC(NC(N)=O)C(=O)Nc1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C13H17N5O3/c1-8(16-12(14)20)11(19)17-9-2-4-10(5-3-9)18-7-6-15-13(18)21/h2-5,8H,6-7H2,1H3,(H,15,21)(H,17,19)(H3,14,16,20)
InChIKeyLXTRKQDXVTTWJG-UHFFFAOYSA-N
MW291.31 g/mol
LogP0.21
Rot. Bonds4

About 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide

2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide (PubChem CID 60707218) has the molecular formula C13H17N5O3 and a molecular weight of 291.31 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide
PubChem CID60707218
Molecular FormulaC13H17N5O3
Molecular Weight291.31 g/mol
Exact Mass291.13
IUPAC Name2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide
SMILESCC(NC(N)=O)C(=O)Nc1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C13H17N5O3/c1-8(16-12(14)20)11(19)17-9-2-4-10(5-3-9)18-7-6-15-13(18)21/h2-5,8H,6-7H2,1H3,(H,15,21)(H,17,19)(H3,14,16,20)
InChIKeyLXTRKQDXVTTWJG-UHFFFAOYSA-N
XLogP0.21
TPSA116.56 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 50.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide;hydrochloride
CID 119276066
N-[1-oxo-1-[4-(2-oxoimidazolidin-1-yl)anilino]propan-2-yl]thiophene-2-carboxamide
CID 51300241
(2S)-2-amino-3,3-dimethyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]butanamide
CID 61178236
(2S)-2-amino-N-[4-(2-oxoimidazolidin-1-yl)phenyl]butanamide;hydrochloride
CID 119276073
2-amino-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 43709823
N-[4-(2-oxoimidazolidin-1-yl)phenyl]but-2-ynamide
CID 107989836
4-[2-(carbamoylamino)propanoylamino]benzamide
CID 24640882
2-(carbamoylamino)-N-(4-propan-2-ylphenyl)propanamide
CID 24641052
N-[4-(2-oxo-1,3-diazinan-1-yl)phenyl]acetamide
CID 110666665
(2R)-N-(4-acetylphenyl)-2-(carbamoylamino)propanamide
CID 2366200
1-ethyl-1-methyl-3-[4-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 78917136
N-[4-(2-oxo-1,3-diazinan-1-yl)phenyl]propanamide
CID 110666666

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide?
The IUPAC name of 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide (CID 60707218) is 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide.
What is the SMILES notation for 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide?
The canonical SMILES for 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide is CC(NC(N)=O)C(=O)Nc1ccc(N2CCNC2=O)cc1.
What is the InChIKey of 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide?
The InChIKey is LXTRKQDXVTTWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O3/c1-8(16-12(14)20)11(19)17-9-2-4-10(5-3-9)18-7-6-15-13(18)21/h2-5,8H,6-7H2,1H3,(H,15,21)(H,17,19)(H3,14,16,20).
What are the key properties of 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide?
2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide has a molecular weight of 291.31 g/mol, XLogP of 0.21, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]propanamide is sourced from PubChem (CID 60707218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).