N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide

C23H20N2O4 — CID 30831158

IUPACN-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide
SMILESCOCC(=O)Nc1cccc(NC(=O)c2oc3c(ccc4ccccc43)c2C)c1
InChIInChI=1S/C23H20N2O4/c1-14-18-11-10-15-6-3-4-9-19(15)22(18)29-21(14)23(27)25-17-8-5-7-16(12-17)24-20(26)13-28-2/h3-12H,13H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyYUXJGOSDFFZRNB-UHFFFAOYSA-N
MW388.42 g/mol
LogP4.73
Rot. Bonds5

About N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide

N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide (PubChem CID 30831158) has the molecular formula C23H20N2O4 and a molecular weight of 388.42 g/mol. Its IUPAC name is N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide
PubChem CID30831158
Molecular FormulaC23H20N2O4
Molecular Weight388.42 g/mol
Exact Mass388.14
IUPAC NameN-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide
SMILESCOCC(=O)Nc1cccc(NC(=O)c2oc3c(ccc4ccccc43)c2C)c1
InChIInChI=1S/C23H20N2O4/c1-14-18-11-10-15-6-3-4-9-19(15)22(18)29-21(14)23(27)25-17-8-5-7-16(12-17)24-20(26)13-28-2/h3-12H,13H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyYUXJGOSDFFZRNB-UHFFFAOYSA-N
XLogP4.73
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7733139
N-(2,3-dimethylphenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7946958
3-methyl-N-[4-(2H-tetrazol-5-yl)phenyl]benzo[g][1]benzofuran-2-carboxamide
CID 166195270
N-(2,5-dichlorophenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7899905
N-(2-bromo-4-methylphenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7929835
N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 46671357
3-methyl-N-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)benzo[g][1]benzofuran-2-carboxamide
CID 167953016
3-methyl-N-(1,3,4-thiadiazol-2-yl)benzo[g][1]benzofuran-2-carboxamide
CID 30550761
N-[2-(2-methoxyethylamino)-2-oxoethyl]-N,3-dimethylbenzo[g][1]benzofuran-2-carboxamide
CID 9076585
3-methyl-N-[4-(morpholin-4-ylmethyl)phenyl]benzo[g][1]benzofuran-2-carboxamide
CID 112797995
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7534992
2-methoxy-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 38397232

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide?
The IUPAC name of N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide (CID 30831158) is N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide.
What is the SMILES notation for N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide?
The canonical SMILES for N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide is COCC(=O)Nc1cccc(NC(=O)c2oc3c(ccc4ccccc43)c2C)c1.
What is the InChIKey of N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide?
The InChIKey is YUXJGOSDFFZRNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O4/c1-14-18-11-10-15-6-3-4-9-19(15)22(18)29-21(14)23(27)25-17-8-5-7-16(12-17)24-20(26)13-28-2/h3-12H,13H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide?
N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide has a molecular weight of 388.42 g/mol, XLogP of 4.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-methoxyacetyl)amino]phenyl]-3-methylbenzo[g][1]benzofuran-2-carboxamide is sourced from PubChem (CID 30831158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).