N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide

C24H16Cl2N2O3 — CID 1007757

IUPACN-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(NC(=O)c2ccc(-c3cc(Cl)ccc3Cl)o2)c1)c1ccccc1
InChIInChI=1S/C24H16Cl2N2O3/c25-16-9-10-20(26)19(13-16)21-11-12-22(31-21)24(30)28-18-8-4-7-17(14-18)27-23(29)15-5-2-1-3-6-15/h1-14H,(H,27,29)(H,28,30)
InChIKeyMKYNOIOLIDIFOA-UHFFFAOYSA-N
MW451.31 g/mol
LogP6.76
Rot. Bonds5

About N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide

N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide (PubChem CID 1007757) has the molecular formula C24H16Cl2N2O3 and a molecular weight of 451.31 g/mol. Its IUPAC name is N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide
PubChem CID1007757
Molecular FormulaC24H16Cl2N2O3
Molecular Weight451.31 g/mol
Exact Mass450.05
IUPAC NameN-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(NC(=O)c2ccc(-c3cc(Cl)ccc3Cl)o2)c1)c1ccccc1
InChIInChI=1S/C24H16Cl2N2O3/c25-16-9-10-20(26)19(13-16)21-11-12-22(31-21)24(30)28-18-8-4-7-17(14-18)27-23(29)15-5-2-1-3-6-15/h1-14H,(H,27,29)(H,28,30)
InChIKeyMKYNOIOLIDIFOA-UHFFFAOYSA-N
XLogP6.76
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.31
LogP ≤ 56.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide
CID 2892817
N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-5-(2,5-dichlorophenyl)furan-2-carboxamide
CID 21170409
5-(2,5-dichlorophenyl)-N-[4-(methylcarbamoyl)phenyl]furan-2-carboxamide
CID 9091487
5-(2,5-dichlorophenyl)-N-[3-(pentanoylamino)phenyl]furan-2-carboxamide
CID 2002810
N-[4-[[5-(2,5-dichlorophenyl)furan-2-carbonyl]amino]phenyl]-1-benzofuran-2-carboxamide
CID 17117653
5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide
CID 9092313
5-(2-chlorophenyl)-N-(3-fluorophenyl)furan-2-carboxamide
CID 9072315
N-(3-benzamido-4-methylphenyl)-5-(3-chlorophenyl)furan-2-carboxamide
CID 1344294
N-[2-(3-chlorophenyl)-1,3-benzoxazol-5-yl]-5-(2,5-dichlorophenyl)furan-2-carboxamide
CID 3125086
N-(3-chloro-4-methylphenyl)-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 1321696
5-[2-chloro-5-(trifluoromethyl)phenyl]-N-(3-methylphenyl)furan-2-carboxamide
CID 3516344
N-[3-chloro-4-[5-(hydroxymethyl)furan-2-yl]phenyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 28669866

Frequently Asked Questions

What is the IUPAC name of N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide?
The IUPAC name of N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide (CID 1007757) is N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide.
What is the SMILES notation for N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide?
The canonical SMILES for N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide is O=C(Nc1cccc(NC(=O)c2ccc(-c3cc(Cl)ccc3Cl)o2)c1)c1ccccc1.
What is the InChIKey of N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide?
The InChIKey is MKYNOIOLIDIFOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16Cl2N2O3/c25-16-9-10-20(26)19(13-16)21-11-12-22(31-21)24(30)28-18-8-4-7-17(14-18)27-23(29)15-5-2-1-3-6-15/h1-14H,(H,27,29)(H,28,30).
What are the key properties of N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide?
N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide has a molecular weight of 451.31 g/mol, XLogP of 6.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide is sourced from PubChem (CID 1007757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).