5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide

C13H12ClNO3 — CID 113290206

IUPAC5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)o2)c(C)c1O
InChIInChI=1S/C13H12ClNO3/c1-7-3-4-9(8(2)12(7)16)15-13(17)10-5-6-11(14)18-10/h3-6,16H,1-2H3,(H,15,17)
InChIKeyLVZPDEHJNYPZRS-UHFFFAOYSA-N
MW265.70 g/mol
LogP3.51
Rot. Bonds2

About 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide

5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide (PubChem CID 113290206) has the molecular formula C13H12ClNO3 and a molecular weight of 265.70 g/mol. Its IUPAC name is 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide
PubChem CID113290206
Molecular FormulaC13H12ClNO3
Molecular Weight265.70 g/mol
Exact Mass265.05
IUPAC Name5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)o2)c(C)c1O
InChIInChI=1S/C13H12ClNO3/c1-7-3-4-9(8(2)12(7)16)15-13(17)10-5-6-11(14)18-10/h3-6,16H,1-2H3,(H,15,17)
InChIKeyLVZPDEHJNYPZRS-UHFFFAOYSA-N
XLogP3.51
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-chlorofuran-2-carbonyl)amino]-5-methylbenzoic acid
CID 28791203
N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide
CID 107697705
5-chloro-N-[4-(3-hydroxyprop-1-ynyl)-2-methylphenyl]furan-2-carboxamide
CID 60802446
3,6-dichloro-N-(3-hydroxy-2,4-dimethylphenyl)pyridine-2-carboxamide
CID 61052606
3-chloro-N-(3-hydroxy-2,4-dimethylphenyl)-4-iodobenzamide
CID 103828130
5-amino-2-bromo-N-(3-hydroxy-2,4-dimethylphenyl)benzamide
CID 115297143
N-(2-bromo-4-methyl-5-nitrophenyl)-5-chlorofuran-2-carboxamide
CID 104696606
N-(3-hydroxy-2,4-dimethylphenyl)-2-iodobenzamide
CID 61400668
5-chloro-N-(4-methyl-3-sulfamoylphenyl)furan-2-carboxamide
CID 34186723
5-bromo-N-(3-chloro-2-methylphenyl)furan-2-carboxamide
CID 675043
5-chloro-N-[2-(1-hydroxyethyl)phenyl]furan-2-carboxamide
CID 54963654
5-chloro-N-(5-methyl-1,2-oxazol-3-yl)furan-2-carboxamide
CID 29494934

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide?
The IUPAC name of 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide (CID 113290206) is 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide is Cc1ccc(NC(=O)c2ccc(Cl)o2)c(C)c1O.
What is the InChIKey of 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide?
The InChIKey is LVZPDEHJNYPZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO3/c1-7-3-4-9(8(2)12(7)16)15-13(17)10-5-6-11(14)18-10/h3-6,16H,1-2H3,(H,15,17).
What are the key properties of 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide?
5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 3.51, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide is sourced from PubChem (CID 113290206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).