N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide

C23H19N3O3 — CID 39678884

IUPACN-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
SMILESCc1ccc2c(CC(=O)Nc3cccc(NC(=O)c4cccnc4)c3)coc2c1
InChIInChI=1S/C23H19N3O3/c1-15-7-8-20-17(14-29-21(20)10-15)11-22(27)25-18-5-2-6-19(12-18)26-23(28)16-4-3-9-24-13-16/h2-10,12-14H,11H2,1H3,(H,25,27)(H,26,28)
InChIKeyNHVGBTCHMWSWGB-UHFFFAOYSA-N
MW385.42 g/mol
LogP4.57
Rot. Bonds5

About N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide

N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide (PubChem CID 39678884) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
PubChem CID39678884
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC NameN-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
SMILESCc1ccc2c(CC(=O)Nc3cccc(NC(=O)c4cccnc4)c3)coc2c1
InChIInChI=1S/C23H19N3O3/c1-15-7-8-20-17(14-29-21(20)10-15)11-22(27)25-18-5-2-6-19(12-18)26-23(28)16-4-3-9-24-13-16/h2-10,12-14H,11H2,1H3,(H,25,27)(H,26,28)
InChIKeyNHVGBTCHMWSWGB-UHFFFAOYSA-N
XLogP4.57
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[2-(3-methylphenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925215
methyl 3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]benzoate
CID 2676406
2-(5-methyl-1-benzofuran-3-yl)-N-pyridin-3-ylacetamide
CID 2973081
N-(3-acetylphenyl)-2-(5-methyl-1-benzofuran-3-yl)acetamide
CID 18872372
N-[3-[[2-(2-chlorophenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925213
N-(3,5-dichlorophenyl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 3968592
N-[2-methoxy-4-[[2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 38662274
N-[3-[[2-(1H-indol-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 46400273
N-[3-[[2-(2-nitrophenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 39678604
N-(3-acetylphenyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 7770634
N-[3-[(2-cyanoacetyl)amino]phenyl]pyridine-3-carboxamide
CID 108922649
2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide
CID 61393726

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide (CID 39678884) is N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide is Cc1ccc2c(CC(=O)Nc3cccc(NC(=O)c4cccnc4)c3)coc2c1.
What is the InChIKey of N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
The InChIKey is NHVGBTCHMWSWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-15-7-8-20-17(14-29-21(20)10-15)11-22(27)25-18-5-2-6-19(12-18)26-23(28)16-4-3-9-24-13-16/h2-10,12-14H,11H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide?
N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide has a molecular weight of 385.42 g/mol, XLogP of 4.57, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 39678884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).