N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide

C19H15Cl2NO3 — CID 19446073

IUPACN-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
SMILESCc1c(Cl)cccc1NC(=O)c1ccc(COc2cccc(Cl)c2)o1
InChIInChI=1S/C19H15Cl2NO3/c1-12-16(21)6-3-7-17(12)22-19(23)18-9-8-15(25-18)11-24-14-5-2-4-13(20)10-14/h2-10H,11H2,1H3,(H,22,23)
InChIKeyJWIUQJRVHYPEJK-UHFFFAOYSA-N
MW376.24 g/mol
LogP5.73
Rot. Bonds5

About N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide

N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide (PubChem CID 19446073) has the molecular formula C19H15Cl2NO3 and a molecular weight of 376.24 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
PubChem CID19446073
Molecular FormulaC19H15Cl2NO3
Molecular Weight376.24 g/mol
Exact Mass375.04
IUPAC NameN-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
SMILESCc1c(Cl)cccc1NC(=O)c1ccc(COc2cccc(Cl)c2)o1
InChIInChI=1S/C19H15Cl2NO3/c1-12-16(21)6-3-7-17(12)22-19(23)18-9-8-15(25-18)11-24-14-5-2-4-13(20)10-14/h2-10H,11H2,1H3,(H,22,23)
InChIKeyJWIUQJRVHYPEJK-UHFFFAOYSA-N
XLogP5.73
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.24
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide
CID 35526540
5-[[4-[(3-chloro-2-methylphenyl)carbamoyl]phenoxy]methyl]furan-2-carboxylic acid
CID 20993932
5-[(3-chlorophenoxy)methyl]-N-(3,4-dichlorophenyl)furan-2-carboxamide
CID 19446098
5-[(3-chlorophenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19446189
N-(2-chlorophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7679417
5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide
CID 19446268
5-[(4-chloro-2-methylphenoxy)methyl]-N-(2,3-dimethylphenyl)furan-2-carboxamide
CID 19457390
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 5-(phenoxymethyl)furan-2-carboxylate
CID 7468764
N-(3-chloro-2-methylphenyl)-4-[(3-chlorophenoxy)methyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 19443894
N-(2,4-dichlorophenyl)-5-[(4-methylphenoxy)methyl]furan-2-carboxamide
CID 18830642
5-[(3-chlorophenoxy)methyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 19446135
5-[(3-chlorophenoxy)methyl]-N-(4-methoxy-2-nitrophenyl)furan-2-carboxamide
CID 19446107

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide (CID 19446073) is N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide is Cc1c(Cl)cccc1NC(=O)c1ccc(COc2cccc(Cl)c2)o1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide?
The InChIKey is JWIUQJRVHYPEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2NO3/c1-12-16(21)6-3-7-17(12)22-19(23)18-9-8-15(25-18)11-24-14-5-2-4-13(20)10-14/h2-10H,11H2,1H3,(H,22,23).
What are the key properties of N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide?
N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide has a molecular weight of 376.24 g/mol, XLogP of 5.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19446073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).