N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide

C19H15N3O4 — CID 75403122

IUPACN-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide
SMILESCC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)NC(=O)NC1=O
InChIInChI=1S/C19H15N3O4/c1-19(17(24)21-18(25)22-19)12-6-8-13(9-7-12)20-16(23)15-10-11-4-2-3-5-14(11)26-15/h2-10H,1H3,(H,20,23)(H2,21,22,24,25)
InChIKeyBQJJOGYAGDYCFE-UHFFFAOYSA-N
MW349.35 g/mol
LogP2.74
Rot. Bonds3

About N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide

N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide (PubChem CID 75403122) has the molecular formula C19H15N3O4 and a molecular weight of 349.35 g/mol. Its IUPAC name is N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide
PubChem CID75403122
Molecular FormulaC19H15N3O4
Molecular Weight349.35 g/mol
Exact Mass349.11
IUPAC NameN-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide
SMILESCC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)NC(=O)NC1=O
InChIInChI=1S/C19H15N3O4/c1-19(17(24)21-18(25)22-19)12-6-8-13(9-7-12)20-16(23)15-10-11-4-2-3-5-14(11)26-15/h2-10H,1H3,(H,20,23)(H2,21,22,24,25)
InChIKeyBQJJOGYAGDYCFE-UHFFFAOYSA-N
XLogP2.74
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.35
LogP ≤ 52.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-(4-iodophenyl)-1-benzofuran-2-carboxamide
CID 986281
[4-(1-benzofuran-2-carbonylamino)phenyl] acetate
CID 6457571
N-[4-(2-oxoimidazolidin-1-yl)phenyl]-1-benzofuran-2-carboxamide
CID 51299992
N-(4-sulfamoylphenyl)-1-benzofuran-2-carboxamide
CID 744283
N-[4-[2-(methoxyamino)-2-oxoethyl]phenyl]-1-benzofuran-2-carboxamide
CID 60572574
N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
CID 1016193
N-[4-[[5-(3,4-dichlorophenyl)furan-2-carbonyl]amino]phenyl]-1-benzofuran-2-carboxamide
CID 17117664
N-[4-(4-nitrophenyl)sulfanylphenyl]-1-benzofuran-2-carboxamide
CID 17296716
N-[4-[(Z)-N-(1-aminoethylideneamino)-C-methylcarbonimidoyl]phenyl]-1-benzofuran-2-carboxamide
CID 91260047
N-[4-(1,3-benzoxazol-2-ylmethyl)phenyl]-1-benzofuran-2-carboxamide
CID 54858220
N-(3-oxo-4H-1,4-benzoxazin-6-yl)-1-benzofuran-2-carboxamide
CID 51153472
N-(4,6-dimethylpyrimidin-2-yl)-1-benzofuran-2-carboxamide
CID 802234

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide (CID 75403122) is N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide is CC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)NC(=O)NC1=O.
What is the InChIKey of N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide?
The InChIKey is BQJJOGYAGDYCFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O4/c1-19(17(24)21-18(25)22-19)12-6-8-13(9-7-12)20-16(23)15-10-11-4-2-3-5-14(11)26-15/h2-10H,1H3,(H,20,23)(H2,21,22,24,25).
What are the key properties of N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide?
N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide has a molecular weight of 349.35 g/mol, XLogP of 2.74, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 75403122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).