5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide

C20H15F2NO6 — CID 19465619

IUPAC5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccccc1OC(F)F)c1ccc(COc2ccc3c(c2)OCO3)o1
InChIInChI=1S/C20H15F2NO6/c21-20(22)29-15-4-2-1-3-14(15)23-19(24)17-8-6-13(28-17)10-25-12-5-7-16-18(9-12)27-11-26-16/h1-9,20H,10-11H2,(H,23,24)
InChIKeyAWVKRADEZARMGX-UHFFFAOYSA-N
MW403.34 g/mol
LogP4.44
Rot. Bonds7

About 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide

5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide (PubChem CID 19465619) has the molecular formula C20H15F2NO6 and a molecular weight of 403.34 g/mol. Its IUPAC name is 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
PubChem CID19465619
Molecular FormulaC20H15F2NO6
Molecular Weight403.34 g/mol
Exact Mass403.09
IUPAC Name5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccccc1OC(F)F)c1ccc(COc2ccc3c(c2)OCO3)o1
InChIInChI=1S/C20H15F2NO6/c21-20(22)29-15-4-2-1-3-14(15)23-19(24)17-8-6-13(28-17)10-25-12-5-7-16-18(9-12)27-11-26-16/h1-9,20H,10-11H2,(H,23,24)
InChIKeyAWVKRADEZARMGX-UHFFFAOYSA-N
XLogP4.44
TPSA79.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.34
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 19463886
5-[(3-chlorophenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19446189
5-[(4-chloro-3-methylphenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19417062
5-(1,3-benzodioxol-5-yloxymethyl)-N-[6-(difluoromethoxy)-1,3-benzothiazol-2-yl]furan-2-carboxamide
CID 4775452
5-[(2,3-dichlorophenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19415778
5-[(4-chloro-2-methylphenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19457516
5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxyphenyl)furan-2-carboxamide
CID 19463936
N-(6-acetyl-1,3-benzodioxol-5-yl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 31483302
5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-methyl-2-nitrophenyl)furan-2-carboxamide
CID 19463925
5-(1,3-benzodioxol-5-yloxymethyl)-N-(2-methoxyethyl)furan-2-carboxamide
CID 19465699
5-(1,3-benzodioxol-5-yloxymethyl)-N-[1-[(4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]furan-2-carboxamide
CID 19465664
5-(1,3-benzodioxol-5-yloxymethyl)-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]furan-2-carboxamide
CID 19465711

Frequently Asked Questions

What is the IUPAC name of 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide?
The IUPAC name of 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide (CID 19465619) is 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide?
The canonical SMILES for 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide is O=C(Nc1ccccc1OC(F)F)c1ccc(COc2ccc3c(c2)OCO3)o1.
What is the InChIKey of 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide?
The InChIKey is AWVKRADEZARMGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2NO6/c21-20(22)29-15-4-2-1-3-14(15)23-19(24)17-8-6-13(28-17)10-25-12-5-7-16-18(9-12)27-11-26-16/h1-9,20H,10-11H2,(H,23,24).
What are the key properties of 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide?
5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide has a molecular weight of 403.34 g/mol, XLogP of 4.44, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,3-benzodioxol-5-yloxymethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide is sourced from PubChem (CID 19465619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).