3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide

C18H16N2O4 — CID 17409565

IUPAC3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
SMILESCOc1ccccc1CC(=O)Nc1c(C(N)=O)oc2ccccc12
InChIInChI=1S/C18H16N2O4/c1-23-13-8-4-2-6-11(13)10-15(21)20-16-12-7-3-5-9-14(12)24-17(16)18(19)22/h2-9H,10H2,1H3,(H2,19,22)(H,20,21)
InChIKeyKAMFDBRECRJSCS-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.72
Rot. Bonds5

About 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide

3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide (PubChem CID 17409565) has the molecular formula C18H16N2O4 and a molecular weight of 324.34 g/mol. Its IUPAC name is 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
PubChem CID17409565
Molecular FormulaC18H16N2O4
Molecular Weight324.34 g/mol
Exact Mass324.11
IUPAC Name3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
SMILESCOc1ccccc1CC(=O)Nc1c(C(N)=O)oc2ccccc12
InChIInChI=1S/C18H16N2O4/c1-23-13-8-4-2-6-11(13)10-15(21)20-16-12-7-3-5-9-14(12)24-17(16)18(19)22/h2-9H,10H2,1H3,(H2,19,22)(H,20,21)
InChIKeyKAMFDBRECRJSCS-UHFFFAOYSA-N
XLogP2.72
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-(4-fluorophenyl)acetyl]amino]-1-benzofuran-2-carboxamide
CID 7385792
ethyl 3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxylate
CID 7117067
3-(pentanoylamino)-1-benzofuran-2-carboxamide
CID 7385691
3-[4-(2-ethoxyphenoxy)butanoylamino]-1-benzofuran-2-carboxamide
CID 17436206
3-[[2-(4-propan-2-ylphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
CID 41362468
3-[[2-(4-methoxyphenyl)sulfonylacetyl]amino]-1-benzofuran-2-carboxamide
CID 18586175
3-[[2-(4-propan-2-ylsulfonylphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
CID 16837991
3-[(4,5-dimethoxy-2-nitrobenzoyl)amino]-1-benzofuran-2-carboxamide
CID 43990998
N-(3-chlorophenyl)-3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
CID 16817375
3-[[2-(4-methylphenyl)sulfonylacetyl]amino]-1-benzofuran-2-carboxamide
CID 43980597
N'-(2-carbamoyl-1-benzofuran-3-yl)-N-[(4-fluorophenyl)methyl]oxamide
CID 18587357
N'-(2-carbamoyl-1-benzofuran-3-yl)-N-[2-(4-methoxyphenyl)ethyl]oxamide
CID 18587367

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide?
The IUPAC name of 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide (CID 17409565) is 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide.
What is the SMILES notation for 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide?
The canonical SMILES for 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide is COc1ccccc1CC(=O)Nc1c(C(N)=O)oc2ccccc12.
What is the InChIKey of 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide?
The InChIKey is KAMFDBRECRJSCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O4/c1-23-13-8-4-2-6-11(13)10-15(21)20-16-12-7-3-5-9-14(12)24-17(16)18(19)22/h2-9H,10H2,1H3,(H2,19,22)(H,20,21).
What are the key properties of 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide?
3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 17409565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).