N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide

C19H14N2O2S — CID 59736777

IUPACN-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide
SMILESNc1ccc(-c2cccs2)cc1NC(=O)c1cc2ccccc2o1
InChIInChI=1S/C19H14N2O2S/c20-14-8-7-13(18-6-3-9-24-18)10-15(14)21-19(22)17-11-12-4-1-2-5-16(12)23-17/h1-11H,20H2,(H,21,22)
InChIKeyMAAFHKDKRJTEKA-UHFFFAOYSA-N
MW334.40 g/mol
LogP5.00
Rot. Bonds3

About N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide

N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide (PubChem CID 59736777) has the molecular formula C19H14N2O2S and a molecular weight of 334.40 g/mol. Its IUPAC name is N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide
PubChem CID59736777
Molecular FormulaC19H14N2O2S
Molecular Weight334.40 g/mol
Exact Mass334.08
IUPAC NameN-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide
SMILESNc1ccc(-c2cccs2)cc1NC(=O)c1cc2ccccc2o1
InChIInChI=1S/C19H14N2O2S/c20-14-8-7-13(18-6-3-9-24-18)10-15(14)21-19(22)17-11-12-4-1-2-5-16(12)23-17/h1-11H,20H2,(H,21,22)
InChIKeyMAAFHKDKRJTEKA-UHFFFAOYSA-N
XLogP5.00
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-5-thiophen-2-ylphenyl)-5-(methylsulfonimidoyl)-1-benzofuran-2-carboxamide
CID 168792406
N-(2-amino-5-thiophen-2-ylphenyl)-2-methyl-1,3-benzoxazole-6-carboxamide
CID 59736937
N-(2-amino-5-thiophen-2-ylphenyl)-4-(benzamidomethyl)benzamide
CID 25157373
3-amino-N-(2-amino-5-thiophen-2-ylphenyl)-4-hydrazinylbenzamide
CID 143026776
N-(2-amino-5-thiophen-2-ylphenyl)-4-methylsulfanylbenzamide
CID 168913825
N-(2-amino-5-thiophen-2-ylphenyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 59736711
N-[4-(thiophene-2-carbonylamino)phenyl]-1-benzofuran-2-carboxamide
CID 1016193
N-(2-amino-5-thiophen-2-ylphenyl)-2-fluoro-4-hydroxybenzamide
CID 150946736
N-(2-amino-4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 24697022
N-(2-amino-5-thiophen-2-ylphenyl)-4-(phenylsulfonimidoyl)benzamide
CID 168792402
CID 88928326
CID 88928326
N-(2-amino-5-thiophen-2-ylphenyl)-4-(3-trimethylsilylpropyl)benzamide
CID 58283961

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide (CID 59736777) is N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide is Nc1ccc(-c2cccs2)cc1NC(=O)c1cc2ccccc2o1.
What is the InChIKey of N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide?
The InChIKey is MAAFHKDKRJTEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2S/c20-14-8-7-13(18-6-3-9-24-18)10-15(14)21-19(22)17-11-12-4-1-2-5-16(12)23-17/h1-11H,20H2,(H,21,22).
What are the key properties of N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide?
N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide has a molecular weight of 334.40 g/mol, XLogP of 5.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 59736777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).