N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide

C18H11Cl2F2NO3 — CID 19453113

IUPACN-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(COc2ccc(F)cc2F)o1
InChIInChI=1S/C18H11Cl2F2NO3/c19-13-4-2-11(8-14(13)20)23-18(24)17-6-3-12(26-17)9-25-16-5-1-10(21)7-15(16)22/h1-8H,9H2,(H,23,24)
InChIKeyXFVKLEDELJPBRI-UHFFFAOYSA-N
MW398.19 g/mol
LogP5.70
Rot. Bonds5

About N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide

N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide (PubChem CID 19453113) has the molecular formula C18H11Cl2F2NO3 and a molecular weight of 398.19 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
PubChem CID19453113
Molecular FormulaC18H11Cl2F2NO3
Molecular Weight398.19 g/mol
Exact Mass397.01
IUPAC NameN-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(COc2ccc(F)cc2F)o1
InChIInChI=1S/C18H11Cl2F2NO3/c19-13-4-2-11(8-14(13)20)23-18(24)17-6-3-12(26-17)9-25-16-5-1-10(21)7-15(16)22/h1-8H,9H2,(H,23,24)
InChIKeyXFVKLEDELJPBRI-UHFFFAOYSA-N
XLogP5.70
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.19
LogP ≤ 55.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-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

N-[3-chloro-4-(difluoromethoxy)phenyl]-5-[(2-chloro-4-fluorophenoxy)methyl]furan-2-carboxamide
CID 19452984
N-(3,5-dichloro-2-pyridinyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
CID 35336225
N-(3,4-dichlorophenyl)-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
CID 19454983
N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
CID 19453250
5-[(2,4-difluorophenoxy)methyl]-N-(4,6-dimethylpyrimidin-2-yl)furan-2-carboxamide
CID 35336375
5-[(2-chloro-5-nitrophenoxy)methyl]-N-(3,4-dichlorophenyl)furan-2-carboxamide
CID 19459453
5-[(3-chlorophenoxy)methyl]-N-(3,4-dichlorophenyl)furan-2-carboxamide
CID 19446098
5-[(2,4-difluorophenoxy)methyl]-N-(4-methyl-3,5-dinitrophenyl)furan-2-carboxamide
CID 19453273
5-[(2,4-difluorophenoxy)methyl]-N-[1-(methoxymethyl)pyrazol-4-yl]furan-2-carboxamide
CID 19453344
N-[4-chloro-3-(trifluoromethyl)phenyl]-5-[(2,4-dichlorophenoxy)methyl]furan-2-carboxamide
CID 126211190
N-[3-chloro-4-(difluoromethoxy)phenyl]-5-[(2-chlorophenoxy)methyl]furan-2-carboxamide
CID 19458716
N-(3,4-dichlorophenyl)-5-[(2,6-dimethylphenoxy)methyl]furan-2-carboxamide
CID 19446793

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide (CID 19453113) is N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(COc2ccc(F)cc2F)o1.
What is the InChIKey of N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
The InChIKey is XFVKLEDELJPBRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11Cl2F2NO3/c19-13-4-2-11(8-14(13)20)23-18(24)17-6-3-12(26-17)9-25-16-5-1-10(21)7-15(16)22/h1-8H,9H2,(H,23,24).
What are the key properties of N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide?
N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide has a molecular weight of 398.19 g/mol, XLogP of 5.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19453113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).