N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide

C18H17NO4 — CID 110703181

IUPACN-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide
SMILESCOc1ccc(NC(=O)c2c(C)oc3ccccc23)c(OC)c1
InChIInChI=1S/C18H17NO4/c1-11-17(13-6-4-5-7-15(13)23-11)18(20)19-14-9-8-12(21-2)10-16(14)22-3/h4-10H,1-3H3,(H,19,20)
InChIKeyUZSSGBHECDZJRD-UHFFFAOYSA-N
MW311.34 g/mol
LogP4.01
Rot. Bonds4

About N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide

N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide (PubChem CID 110703181) has the molecular formula C18H17NO4 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide
PubChem CID110703181
Molecular FormulaC18H17NO4
Molecular Weight311.34 g/mol
Exact Mass311.12
IUPAC NameN-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide
SMILESCOc1ccc(NC(=O)c2c(C)oc3ccccc23)c(OC)c1
InChIInChI=1S/C18H17NO4/c1-11-17(13-6-4-5-7-15(13)23-11)18(20)19-14-9-8-12(21-2)10-16(14)22-3/h4-10H,1-3H3,(H,19,20)
InChIKeyUZSSGBHECDZJRD-UHFFFAOYSA-N
XLogP4.01
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethoxyphenyl)-2,4-dimethyl-6-oxopyran-3-carboxamide
CID 660643
N-(2-bromophenyl)-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 51065520
N-(2,4-dimethoxyphenyl)-2-(4-oxochromen-2-yl)acetamide
CID 10735810
2,4-dimethoxy-N-(2-methoxydibenzofuran-3-yl)benzamide
CID 2884928
N-(2,4-dimethoxyphenyl)-1-oxoisochromene-3-carboxamide
CID 99797944
N-(2,4-dimethoxyphenyl)-3-phenylcinnoline-4-carboxamide
CID 46287961
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
N-(2,4-dimethoxyphenyl)-3-(3-phenylpropanoylamino)-1-benzofuran-2-carboxamide
CID 16814944
5-methoxy-2-methyl-N-(3-methylphenyl)-1-benzofuran-3-carboxamide
CID 51065526
N-(2,4-dimethoxyphenyl)-3-[[2-(3-methylphenoxy)acetyl]amino]-1-benzofuran-2-carboxamide
CID 20875443
3-[(2-cyclopentylacetyl)amino]-N-(2,4-dimethoxyphenyl)-1-benzofuran-2-carboxamide
CID 7160217
N-(2,4-dimethoxyphenyl)-5-methyl-1,3,4-oxadiazole-2-carboxamide
CID 110392914

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide (CID 110703181) is N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide is COc1ccc(NC(=O)c2c(C)oc3ccccc23)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide?
The InChIKey is UZSSGBHECDZJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO4/c1-11-17(13-6-4-5-7-15(13)23-11)18(20)19-14-9-8-12(21-2)10-16(14)22-3/h4-10H,1-3H3,(H,19,20).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide?
N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide has a molecular weight of 311.34 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide is sourced from PubChem (CID 110703181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).