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

C18H13Cl2NO3 — CID 35526540

IUPAC5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(COc2cccc(Cl)c2)o1
InChIInChI=1S/C18H13Cl2NO3/c19-12-4-3-5-13(10-12)23-11-14-8-9-17(24-14)18(22)21-16-7-2-1-6-15(16)20/h1-10H,11H2,(H,21,22)
InChIKeyZEHGXHMIKFKZNT-UHFFFAOYSA-N
MW362.21 g/mol
LogP5.42
Rot. Bonds5

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

5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide (PubChem CID 35526540) has the molecular formula C18H13Cl2NO3 and a molecular weight of 362.21 g/mol. Its IUPAC name is 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide
PubChem CID35526540
Molecular FormulaC18H13Cl2NO3
Molecular Weight362.21 g/mol
Exact Mass361.03
IUPAC Name5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(COc2cccc(Cl)c2)o1
InChIInChI=1S/C18H13Cl2NO3/c19-12-4-3-5-13(10-12)23-11-14-8-9-17(24-14)18(22)21-16-7-2-1-6-15(16)20/h1-10H,11H2,(H,21,22)
InChIKeyZEHGXHMIKFKZNT-UHFFFAOYSA-N
XLogP5.42
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.21
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylphenyl)-5-[(3-chlorophenoxy)methyl]furan-2-carboxamide
CID 19446073
N-(2-chlorophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7679417
5-[(3-chlorophenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19446189
5-[(3-chlorophenoxy)methyl]-N-(3,4-dichlorophenyl)furan-2-carboxamide
CID 19446098
5-[(2,5-dichlorophenoxy)methyl]-N-(2,3-dichlorophenyl)furan-2-carboxamide
CID 1269599
N-(2,4-dichlorophenyl)-5-[(4-methylphenoxy)methyl]furan-2-carboxamide
CID 18830642
5-[(3-chlorophenoxy)methyl]-N-(3,5-dimethyl-1,2-oxazol-4-yl)furan-2-carboxamide
CID 19446268
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
N-(2-hydroxyphenyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19460984
N-(2,4-dichlorophenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 51781977
4-[[5-[(3-chlorophenoxy)methyl]furan-2-carbonyl]amino]-1-ethylpyrazole-3-carboxamide
CID 19412473

Frequently Asked Questions

What is the IUPAC name of 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide?
The IUPAC name of 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide (CID 35526540) is 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide.
What is the SMILES notation for 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide?
The canonical SMILES for 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide is O=C(Nc1ccccc1Cl)c1ccc(COc2cccc(Cl)c2)o1.
What is the InChIKey of 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide?
The InChIKey is ZEHGXHMIKFKZNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2NO3/c19-12-4-3-5-13(10-12)23-11-14-8-9-17(24-14)18(22)21-16-7-2-1-6-15(16)20/h1-10H,11H2,(H,21,22).
What are the key properties of 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide?
5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide has a molecular weight of 362.21 g/mol, XLogP of 5.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-chlorophenoxy)methyl]-N-(2-chlorophenyl)furan-2-carboxamide is sourced from PubChem (CID 35526540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).