2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide

C12H14N4O4S — CID 60668873

IUPAC2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide
SMILESCC(NC(=O)c1c[nH]c(=O)[nH]1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H14N4O4S/c1-7(15-11(17)10-6-14-12(18)16-10)8-2-4-9(5-3-8)21(13,19)20/h2-7H,1H3,(H,15,17)(H2,13,19,20)(H2,14,16,18)
InChIKeyVEEQPTZVVVNWQP-UHFFFAOYSA-N
MW310.34 g/mol
LogP-0.16
Rot. Bonds4

About 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide

2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide (PubChem CID 60668873) has the molecular formula C12H14N4O4S and a molecular weight of 310.34 g/mol. Its IUPAC name is 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide
PubChem CID60668873
Molecular FormulaC12H14N4O4S
Molecular Weight310.34 g/mol
Exact Mass310.07
IUPAC Name2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide
SMILESCC(NC(=O)c1c[nH]c(=O)[nH]1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H14N4O4S/c1-7(15-11(17)10-6-14-12(18)16-10)8-2-4-9(5-3-8)21(13,19)20/h2-7H,1H3,(H,15,17)(H2,13,19,20)(H2,14,16,18)
InChIKeyVEEQPTZVVVNWQP-UHFFFAOYSA-N
XLogP-0.16
TPSA137.91 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.34
LogP ≤ 5-0.16
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-sulfamoylphenyl)ethyl]-2H-triazole-4-carboxamide
CID 112732641
5-methyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide
CID 2594407
N-[1-(3-bromophenyl)ethyl]-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 60739691
1-propan-2-yl-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea
CID 25362862
N-(2-bromo-4-sulfamoylphenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 61128605
2-bromo-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 107903643
3-methyl-N-[1-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide
CID 51146589
5-bromo-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide
CID 8003959
3-amino-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 43702371
5-chloro-2-fluoro-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 27759607
1,1-diethyl-3-[(1R)-1-(4-sulfamoylphenyl)ethyl]urea
CID 129375380
2-[2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethoxy]acetic acid
CID 60708265

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide (CID 60668873) is 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide is CC(NC(=O)c1c[nH]c(=O)[nH]1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is VEEQPTZVVVNWQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O4S/c1-7(15-11(17)10-6-14-12(18)16-10)8-2-4-9(5-3-8)21(13,19)20/h2-7H,1H3,(H,15,17)(H2,13,19,20)(H2,14,16,18).
What are the key properties of 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide?
2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 310.34 g/mol, XLogP of -0.16, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[1-(4-sulfamoylphenyl)ethyl]-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 60668873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).