5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide

C13H12ClNO3 — CID 32739421

IUPAC5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccccc1CNC(=O)c1ccc(Cl)o1
InChIInChI=1S/C13H12ClNO3/c1-17-10-5-3-2-4-9(10)8-15-13(16)11-6-7-12(14)18-11/h2-7H,8H2,1H3,(H,15,16)
InChIKeyIMEPFTDIKZHDGM-UHFFFAOYSA-N
MW265.70 g/mol
LogP2.87
Rot. Bonds4

About 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide

5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide (PubChem CID 32739421) has the molecular formula C13H12ClNO3 and a molecular weight of 265.70 g/mol. Its IUPAC name is 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
PubChem CID32739421
Molecular FormulaC13H12ClNO3
Molecular Weight265.70 g/mol
Exact Mass265.05
IUPAC Name5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccccc1CNC(=O)c1ccc(Cl)o1
InChIInChI=1S/C13H12ClNO3/c1-17-10-5-3-2-4-9(10)8-15-13(16)11-6-7-12(14)18-11/h2-7H,8H2,1H3,(H,15,16)
InChIKeyIMEPFTDIKZHDGM-UHFFFAOYSA-N
XLogP2.87
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-[(2,3,4-trimethoxyphenyl)methyl]furan-2-carboxamide
CID 86925580
N-[(5-chlorofuran-2-yl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110732020
7-bromo-N-[(2-methoxyphenyl)methyl]-1-benzofuran-2-carboxamide
CID 39709859
5-[(2,6-dimethylphenyl)sulfanylmethyl]-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
CID 21046099
N-[(2-methoxyphenyl)methyl]-2-phenyl-1,3-oxazole-5-carboxamide
CID 110681416
N-[(2-methoxyphenyl)methyl]-5-[(2-methoxyphenyl)sulfonylmethyl]furan-2-carboxamide
CID 3242702
N-[(2-methoxyphenyl)methyl]-1,2-oxazole-5-carboxamide
CID 110693577
2-(3-chloro-4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 110767041
2-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 808183
N-[(5-bromo-2-methoxyphenyl)methyl]-5-[(2-chlorophenyl)methylsulfanylmethyl]furan-2-carboxamide
CID 4533618
5-bromo-N-[4-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]phenyl]furan-2-carboxamide
CID 46488649
5-bromo-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 62953516

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide?
The IUPAC name of 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide (CID 32739421) is 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide is COc1ccccc1CNC(=O)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide?
The InChIKey is IMEPFTDIKZHDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO3/c1-17-10-5-3-2-4-9(10)8-15-13(16)11-6-7-12(14)18-11/h2-7H,8H2,1H3,(H,15,16).
What are the key properties of 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide?
5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 32739421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).