N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide

C19H18N2O4 — CID 71480807

IUPACN-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide
SMILESCOc1ccc(C(=O)NCCNC(=O)c2cc3ccccc3o2)cc1
InChIInChI=1S/C19H18N2O4/c1-24-15-8-6-13(7-9-15)18(22)20-10-11-21-19(23)17-12-14-4-2-3-5-16(14)25-17/h2-9,12H,10-11H2,1H3,(H,20,22)(H,21,23)
InChIKeyFKVAWPBUMQRPRC-UHFFFAOYSA-N
MW338.36 g/mol
LogP2.60
Rot. Bonds6

About N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide

N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide (PubChem CID 71480807) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide
PubChem CID71480807
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC NameN-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide
SMILESCOc1ccc(C(=O)NCCNC(=O)c2cc3ccccc3o2)cc1
InChIInChI=1S/C19H18N2O4/c1-24-15-8-6-13(7-9-15)18(22)20-10-11-21-19(23)17-12-14-4-2-3-5-16(14)25-17/h2-9,12H,10-11H2,1H3,(H,20,22)(H,21,23)
InChIKeyFKVAWPBUMQRPRC-UHFFFAOYSA-N
XLogP2.60
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(4-propoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide
CID 71480810
N-[2-[4-(1-benzofuran-2-carbonyl)piperazin-1-yl]ethyl]-4-methoxybenzamide
CID 41136212
N-[2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide
CID 62659751
N-[[1-[2-(1-benzofuran-2-yl)-2-oxoacetyl]piperidin-4-yl]methyl]-4-methoxybenzamide
CID 56588504
2-benzamidoethyl 1-benzofuran-2-carboxylate
CID 569920
(4-methoxyphenyl) 1-benzofuran-2-carboxylate
CID 659898
5-bromo-N-[2-[(4-methoxybenzoyl)amino]ethyl]furan-2-carboxamide
CID 108537811
N-[2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]ethyl]-1-benzofuran-2-carboxamide
CID 90515898
N-[(1R)-1-(4-methoxyphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 39358745
N-(3-iodopropyl)-1-benzofuran-2-carboxamide
CID 114504013
methyl (2S)-2-(1-benzofuran-2-carbonylamino)-3-(4-methoxyphenyl)propanoate
CID 86655478
N-[(4-acetylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 20677387

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide (CID 71480807) is N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide is COc1ccc(C(=O)NCCNC(=O)c2cc3ccccc3o2)cc1.
What is the InChIKey of N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide?
The InChIKey is FKVAWPBUMQRPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-24-15-8-6-13(7-9-15)18(22)20-10-11-21-19(23)17-12-14-4-2-3-5-16(14)25-17/h2-9,12H,10-11H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide?
N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide has a molecular weight of 338.36 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 71480807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).