N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide

C23H20N2O3 — CID 55370282

IUPACN-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide
SMILESCOCc1c(C(=O)Nc2ccc(Nc3ccccc3)cc2)oc2ccccc12
InChIInChI=1S/C23H20N2O3/c1-27-15-20-19-9-5-6-10-21(19)28-22(20)23(26)25-18-13-11-17(12-14-18)24-16-7-3-2-4-8-16/h2-14,24H,15H2,1H3,(H,25,26)
InChIKeyOCFSVECGIDMSGX-UHFFFAOYSA-N
MW372.42 g/mol
LogP5.58
Rot. Bonds6

About N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide

N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide (PubChem CID 55370282) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide
PubChem CID55370282
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC NameN-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide
SMILESCOCc1c(C(=O)Nc2ccc(Nc3ccccc3)cc2)oc2ccccc12
InChIInChI=1S/C23H20N2O3/c1-27-15-20-19-9-5-6-10-21(19)28-22(20)23(26)25-18-13-11-17(12-14-18)24-16-7-3-2-4-8-16/h2-14,24H,15H2,1H3,(H,25,26)
InChIKeyOCFSVECGIDMSGX-UHFFFAOYSA-N
XLogP5.58
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.42
LogP ≤ 55.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-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

propyl 4-[[3-(methoxymethyl)-1-benzofuran-2-carbonyl]amino]benzoate
CID 29456795
3-(methoxymethyl)-N-[4-(2,2,2-trifluoroethoxy)phenyl]-1-benzofuran-2-carboxamide
CID 55478663
3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide
CID 18084321
3-(methoxymethyl)-N-naphthalen-1-yl-1-benzofuran-2-carboxamide
CID 7734068
3-(methoxymethyl)-N-(3-nitrophenyl)-1-benzofuran-2-carboxamide
CID 9070735
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 49170375
N-tert-butyl-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 8779973
N-(2-methoxyethyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 9205135
N-(3-benzamido-2-methylphenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 55899409
N-(4-methylsulfonylphenyl)-3-(phenoxymethyl)-1-benzofuran-2-carboxamide
CID 18775166
3-(methoxymethyl)-N-[(2S)-2-phenylpropyl]-1-benzofuran-2-carboxamide
CID 9089939
N-[2-(dimethylamino)-2-phenylethyl]-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 51153654

Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide (CID 55370282) is N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide is COCc1c(C(=O)Nc2ccc(Nc3ccccc3)cc2)oc2ccccc12.
What is the InChIKey of N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide?
The InChIKey is OCFSVECGIDMSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-27-15-20-19-9-5-6-10-21(19)28-22(20)23(26)25-18-13-11-17(12-14-18)24-16-7-3-2-4-8-16/h2-14,24H,15H2,1H3,(H,25,26).
What are the key properties of N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide?
N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide has a molecular weight of 372.42 g/mol, XLogP of 5.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-3-(methoxymethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 55370282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).