5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide

C18H13Cl2NO3 — CID 9092313

IUPAC5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(CO)c1)c1ccc(-c2ccc(Cl)cc2Cl)o1
InChIInChI=1S/C18H13Cl2NO3/c19-12-4-5-14(15(20)9-12)16-6-7-17(24-16)18(23)21-13-3-1-2-11(8-13)10-22/h1-9,22H,10H2,(H,21,23)
InChIKeyUIOGLXUTWNOWCP-UHFFFAOYSA-N
MW362.21 g/mol
LogP5.00
Rot. Bonds4

About 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide

5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide (PubChem CID 9092313) has the molecular formula C18H13Cl2NO3 and a molecular weight of 362.21 g/mol. Its IUPAC name is 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide
PubChem CID9092313
Molecular FormulaC18H13Cl2NO3
Molecular Weight362.21 g/mol
Exact Mass361.03
IUPAC Name5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(CO)c1)c1ccc(-c2ccc(Cl)cc2Cl)o1
InChIInChI=1S/C18H13Cl2NO3/c19-12-4-5-14(15(20)9-12)16-6-7-17(24-16)18(23)21-13-3-1-2-11(8-13)10-22/h1-9,22H,10H2,(H,21,23)
InChIKeyUIOGLXUTWNOWCP-UHFFFAOYSA-N
XLogP5.00
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.21
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-chloro-4-[5-(hydroxymethyl)furan-2-yl]phenyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 28669866
N-(3-chloro-4-methylphenyl)-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 1321696
5-(2,4-dichlorophenyl)-N-(3,5-dimethylphenyl)furan-2-carboxamide
CID 23991423
N-(3-benzamidophenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide
CID 1007757
N-(3-chloro-4-pyrrolidin-1-ylphenyl)-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 17272468
N-(3-acetylphenyl)-5-(2,5-dichlorophenyl)furan-2-carboxamide
CID 2892817
N-[3-chloro-4-[5-(hydroxymethyl)furan-2-yl]phenyl]-5-(3,5-dichlorophenyl)furan-2-carboxamide
CID 28670148
5-(2,5-dichlorophenyl)-N-[3-(pentanoylamino)phenyl]furan-2-carboxamide
CID 2002810
2-[3-[[5-(2,4-dichlorophenyl)furan-2-carbonyl]amino]phenyl]quinoline-4-carboxylic acid
CID 5262478
5-(2,4-dichlorophenyl)-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide
CID 5262514
5-(2,4-dichlorophenyl)-N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]furan-2-carboxamide
CID 17110645
5-(2-chlorophenyl)-N-(3-fluorophenyl)furan-2-carboxamide
CID 9072315

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide?
The IUPAC name of 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide (CID 9092313) is 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide?
The canonical SMILES for 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide is O=C(Nc1cccc(CO)c1)c1ccc(-c2ccc(Cl)cc2Cl)o1.
What is the InChIKey of 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide?
The InChIKey is UIOGLXUTWNOWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2NO3/c19-12-4-5-14(15(20)9-12)16-6-7-17(24-16)18(23)21-13-3-1-2-11(8-13)10-22/h1-9,22H,10H2,(H,21,23).
What are the key properties of 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide?
5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide has a molecular weight of 362.21 g/mol, XLogP of 5.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichlorophenyl)-N-[3-(hydroxymethyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 9092313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).