N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide

C23H17NO4 — CID 42571061

IUPACN-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(C(=O)c2cc3ccccc3o2)cc1
InChIInChI=1S/C23H17NO4/c1-27-20-9-5-3-7-18(20)23(26)24-17-12-10-15(11-13-17)22(25)21-14-16-6-2-4-8-19(16)28-21/h2-14H,1H3,(H,24,26)
InChIKeyXRINXVLCSTZHCL-UHFFFAOYSA-N
MW371.39 g/mol
LogP4.92
Rot. Bonds5

About N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide

N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide (PubChem CID 42571061) has the molecular formula C23H17NO4 and a molecular weight of 371.39 g/mol. Its IUPAC name is N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide
PubChem CID42571061
Molecular FormulaC23H17NO4
Molecular Weight371.39 g/mol
Exact Mass371.12
IUPAC NameN-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(C(=O)c2cc3ccccc3o2)cc1
InChIInChI=1S/C23H17NO4/c1-27-20-9-5-3-7-18(20)23(26)24-17-12-10-15(11-13-17)22(25)21-14-16-6-2-4-8-19(16)28-21/h2-14H,1H3,(H,24,26)
InChIKeyXRINXVLCSTZHCL-UHFFFAOYSA-N
XLogP4.92
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.39
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
The IUPAC name of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide (CID 42571061) is N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide.
What is the SMILES notation for N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
The canonical SMILES for N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(C(=O)c2cc3ccccc3o2)cc1.
What is the InChIKey of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
The InChIKey is XRINXVLCSTZHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO4/c1-27-20-9-5-3-7-18(20)23(26)24-17-12-10-15(11-13-17)22(25)21-14-16-6-2-4-8-19(16)28-21/h2-14H,1H3,(H,24,26).
What are the key properties of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide has a molecular weight of 371.39 g/mol, XLogP of 4.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide is sourced from PubChem (CID 42571061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).