N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide

C16H13NO3 — CID 725675

IUPACN-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3ccccc3o2)cc1
InChIInChI=1S/C16H13NO3/c1-19-13-8-6-12(7-9-13)17-16(18)15-10-11-4-2-3-5-14(11)20-15/h2-10H,1H3,(H,17,18)
InChIKeyTXXUEJSPPYBINY-UHFFFAOYSA-N
MW267.28 g/mol
LogP3.69
Rot. Bonds3

About N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide

N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide (PubChem CID 725675) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
PubChem CID725675
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC NameN-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3ccccc3o2)cc1
InChIInChI=1S/C16H13NO3/c1-19-13-8-6-12(7-9-13)17-16(18)15-10-11-4-2-3-5-14(11)20-15/h2-10H,1H3,(H,17,18)
InChIKeyTXXUEJSPPYBINY-UHFFFAOYSA-N
XLogP3.69
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-1-benzofuran-2-carboxamide
CID 675185
N-(4-fluorophenyl)-1-benzofuran-2-carboxamide
CID 725640
N-(4-methylphenyl)-1-benzofuran-2-carboxamide
CID 725663
N-(1-phenylethyl)-1-benzofuran-2-carboxamide
CID 2788390
N-(2-Benzoyl-3-benzofuranyl)acetamide
CID 616884
3-Amino-N-(4-chlorophenyl)-1-benzofuran-2-carboxamide
CID 1083209
N-[2-(trifluoromethyl)phenyl]-1-benzofuran-2-carboxamide
CID 725651
N-[4-(5-{[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl}furan-2-yl)phenyl]-1-benzofuran-2-carboxamide
CID 44182307
3-methyl-N-phenyl-N-(3-(piperidin-1-yl)propyl)benzofuran-2-carboxamide
CID 71452341
N-[4-(hexanoylamino)-2-methoxyphenyl]-1-benzofuran-2-carboxamide
CID 1868107
N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)benzofuran-2-carboxamide
CID 10092819
N-[4-[4-(3-Cyanophenyl)piperazin-1-yl]butyl]benzo[b]furan-2-carboxamide
CID 11596521

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide (CID 725675) is N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide is COc1ccc(NC(=O)c2cc3ccccc3o2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
The InChIKey is TXXUEJSPPYBINY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c1-19-13-8-6-12(7-9-13)17-16(18)15-10-11-4-2-3-5-14(11)20-15/h2-10H,1H3,(H,17,18).
What are the key properties of N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide has a molecular weight of 267.28 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 725675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).