N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide

C17H14N2O3 — CID 110703184

IUPACN-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide
SMILESCc1oc2ccccc2c1C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C17H14N2O3/c1-10-15(13-4-2-3-5-14(13)22-10)17(21)19-12-8-6-11(7-9-12)16(18)20/h2-9H,1H3,(H2,18,20)(H,19,21)
InChIKeyWFXSNVXZNHDNNN-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.09
Rot. Bonds3

About N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide

N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide (PubChem CID 110703184) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide
PubChem CID110703184
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC NameN-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide
SMILESCc1oc2ccccc2c1C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C17H14N2O3/c1-10-15(13-4-2-3-5-14(13)22-10)17(21)19-12-8-6-11(7-9-12)16(18)20/h2-9H,1H3,(H2,18,20)(H,19,21)
InChIKeyWFXSNVXZNHDNNN-UHFFFAOYSA-N
XLogP3.09
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,3-benzodioxol-5-yl)-2-methyl-1-benzofuran-3-carboxamide
CID 110703196
N-(4-carbamoylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 17015561
1-N,4-N-bis(4-carbamoylphenyl)benzene-1,4-dicarboxamide
CID 1272826
N-(4-carbamoylphenyl)-2,6-dimethoxybenzamide
CID 4126051
2-methyl-5-[(2-methylphenyl)sulfonylamino]-N-phenyl-1-benzofuran-3-carboxamide
CID 25037862
[(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl] 3-methyl-1-benzofuran-2-carboxylate
CID 7239318
N-(4-carbamothioylphenyl)-2,4,5-trimethylfuran-3-carboxamide
CID 65152789
N-(4-carbamoylphenyl)-3-methyl-4-oxo-2-phenylchromene-8-carboxamide
CID 8884598
3-[[4-(2-methylpropanoylamino)benzoyl]amino]-1-benzofuran-2-carboxamide
CID 167790473
N-(4-carbamoylphenyl)-2-oxochromene-3-carboxamide
CID 717683
4-N-(4-acetamidophenyl)benzene-1,4-dicarboxamide
CID 27648779
N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide
CID 110703181

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide?
The IUPAC name of N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide (CID 110703184) is N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide.
What is the SMILES notation for N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide?
The canonical SMILES for N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide is Cc1oc2ccccc2c1C(=O)Nc1ccc(C(N)=O)cc1.
What is the InChIKey of N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide?
The InChIKey is WFXSNVXZNHDNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-10-15(13-4-2-3-5-14(13)22-10)17(21)19-12-8-6-11(7-9-12)16(18)20/h2-9H,1H3,(H2,18,20)(H,19,21).
What are the key properties of N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide?
N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 3.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylphenyl)-2-methyl-1-benzofuran-3-carboxamide is sourced from PubChem (CID 110703184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).