7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide

C19H19NO3 — CID 53281692

IUPAC7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)NC(C)c3ccc(C)cc3)oc12
InChIInChI=1S/C19H19NO3/c1-12-7-9-14(10-8-12)13(2)20-19(21)17-11-15-5-4-6-16(22-3)18(15)23-17/h4-11,13H,1-3H3,(H,20,21)
InChIKeySMOFZTULECTCAF-UHFFFAOYSA-N
MW309.37 g/mol
LogP4.24
Rot. Bonds4

About 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide

7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide (PubChem CID 53281692) has the molecular formula C19H19NO3 and a molecular weight of 309.37 g/mol. Its IUPAC name is 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide
PubChem CID53281692
Molecular FormulaC19H19NO3
Molecular Weight309.37 g/mol
Exact Mass309.14
IUPAC Name7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)NC(C)c3ccc(C)cc3)oc12
InChIInChI=1S/C19H19NO3/c1-12-7-9-14(10-8-12)13(2)20-19(21)17-11-15-5-4-6-16(22-3)18(15)23-17/h4-11,13H,1-3H3,(H,20,21)
InChIKeySMOFZTULECTCAF-UHFFFAOYSA-N
XLogP4.24
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-ethylphenyl)ethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 133178584
N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 94012379
7-methoxy-N-[1-(4-methylsulfonylphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 133165504
7-methoxy-N-[(1R)-1-(4-nitrophenyl)ethyl]-1-benzofuran-2-carboxamide
CID 11588130
7-methoxy-N-[1-[4-(2-methoxyethylsulfanyl)phenyl]ethyl]-1-benzofuran-2-carboxamide
CID 86889000
N-[(1S)-1-(4-methoxyphenyl)ethyl]-7-methyl-1-benzofuran-2-carboxamide
CID 100795374
7-methoxy-N-[1-[4-(3-methylpiperidin-1-yl)phenyl]ethyl]-1-benzofuran-2-carboxamide
CID 132659671
7-methoxy-N-[(1S)-1-[4-[(3S)-3-methylpiperidin-1-yl]phenyl]ethyl]-1-benzofuran-2-carboxamide
CID 125042405
7-methoxy-N-methyl-1-benzofuran-2-carboxamide
CID 53281820
N-[1-(7-methoxy-1-benzofuran-2-yl)ethyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 47024453
2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide
CID 43876733
3-methoxy-N-[(1R)-1-(4-methylphenyl)ethyl]naphthalene-2-carboxamide
CID 28633409

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide?
The IUPAC name of 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide (CID 53281692) is 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide is COc1cccc2cc(C(=O)NC(C)c3ccc(C)cc3)oc12.
What is the InChIKey of 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide?
The InChIKey is SMOFZTULECTCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c1-12-7-9-14(10-8-12)13(2)20-19(21)17-11-15-5-4-6-16(22-3)18(15)23-17/h4-11,13H,1-3H3,(H,20,21).
What are the key properties of 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide?
7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 4.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 53281692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).