5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide

C17H16N2O3 — CID 166386675

IUPAC5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide
SMILESCc1cc(C(=O)NCCn2ccc(=O)cc2)c2occc2c1
InChIInChI=1S/C17H16N2O3/c1-12-10-13-4-9-22-16(13)15(11-12)17(21)18-5-8-19-6-2-14(20)3-7-19/h2-4,6-7,9-11H,5,8H2,1H3,(H,18,21)
InChIKeyYDNNEMRQCRGRPC-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.33
Rot. Bonds4

About 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide

5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide (PubChem CID 166386675) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide
PubChem CID166386675
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC Name5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide
SMILESCc1cc(C(=O)NCCn2ccc(=O)cc2)c2occc2c1
InChIInChI=1S/C17H16N2O3/c1-12-10-13-4-9-22-16(13)15(11-12)17(21)18-5-8-19-6-2-14(20)3-7-19/h2-4,6-7,9-11H,5,8H2,1H3,(H,18,21)
InChIKeyYDNNEMRQCRGRPC-UHFFFAOYSA-N
XLogP2.33
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-N-(2-pyrrol-1-ylethyl)furan-3-carboxamide
CID 106898976
3-hydroxy-N-(2-pyrrol-1-ylethyl)naphthalene-2-carboxamide
CID 103722595
7-methyl-1-oxo-N-(2-pyrrol-1-ylethyl)isochromene-3-carboxamide
CID 172882439
3-methyl-4-oxo-2-phenyl-N-(2-pyrrol-1-ylethyl)chromene-8-carboxamide
CID 125433000
3-hydroxy-N-(2-pyrrol-1-ylethyl)pyridine-4-carboxamide
CID 103762370
2-hydroxy-5-iodo-N-(2-pyrrol-1-ylethyl)benzamide
CID 103725448
1-[2-[(2-amino-5-methylbenzoyl)amino]ethyl]imidazole-4-carboxylic acid
CID 107500533
1-[2-(2-methoxyethylamino)ethyl]pyridin-4-one
CID 62881033
2-bromo-N-(2-pyrrol-1-ylethyl)benzamide
CID 110716239
N,N'-bis[2-(2-methyl-4-oxo-1-pyridinyl)ethyl]propanediamide
CID 132528861
N-[2-[bis[2-[(2,3-dihydroxy-5-methylbenzoyl)amino]ethyl]amino]ethyl]-2,3-dihydroxy-5-methylbenzamide
CID 102443937
N-(3-imidazol-1-ylpropyl)-2-methylfuran-3-carboxamide
CID 3766728

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide?
The IUPAC name of 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide (CID 166386675) is 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide.
What is the SMILES notation for 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide?
The canonical SMILES for 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide is Cc1cc(C(=O)NCCn2ccc(=O)cc2)c2occc2c1.
What is the InChIKey of 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide?
The InChIKey is YDNNEMRQCRGRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c1-12-10-13-4-9-22-16(13)15(11-12)17(21)18-5-8-19-6-2-14(20)3-7-19/h2-4,6-7,9-11H,5,8H2,1H3,(H,18,21).
What are the key properties of 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide?
5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[2-(4-oxo-1-pyridinyl)ethyl]-1-benzofuran-7-carboxamide is sourced from PubChem (CID 166386675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).