N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide

C17H18Cl2N2O4 — CID 86912260

IUPACN-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide
SMILESCCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(COC)o1
InChIInChI=1S/C17H18Cl2N2O4/c1-3-21(17(23)14-8-7-11(25-14)10-24-2)9-15(22)20-16-12(18)5-4-6-13(16)19/h4-8H,3,9-10H2,1-2H3,(H,20,22)
InChIKeyIZUVAQACCRCNPP-UHFFFAOYSA-N
MW385.25 g/mol
LogP3.83
Rot. Bonds7

About N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide

N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide (PubChem CID 86912260) has the molecular formula C17H18Cl2N2O4 and a molecular weight of 385.25 g/mol. Its IUPAC name is N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide
PubChem CID86912260
Molecular FormulaC17H18Cl2N2O4
Molecular Weight385.25 g/mol
Exact Mass384.06
IUPAC NameN-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide
SMILESCCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(COC)o1
InChIInChI=1S/C17H18Cl2N2O4/c1-3-21(17(23)14-8-7-11(25-14)10-24-2)9-15(22)20-16-12(18)5-4-6-13(16)19/h4-8H,3,9-10H2,1-2H3,(H,20,22)
InChIKeyIZUVAQACCRCNPP-UHFFFAOYSA-N
XLogP3.83
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.25
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-(methoxymethyl)-N-[(2-methylphenyl)methyl]furan-2-carboxamide
CID 78852716
N-ethyl-5-(methoxymethyl)-N-(2-methylpropyl)furan-2-carboxamide
CID 86926941
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-4-phenylmethoxybenzamide
CID 27744494
2-(4-chlorophenyl)-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethylacetamide
CID 25314063
2-bromo-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethylbenzamide
CID 34169565
4-tert-butyl-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethylbenzamide
CID 25313738
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-2-(4-ethoxyphenyl)-N-ethylacetamide
CID 24553205
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-4-phenoxybenzamide
CID 25313751
2-chloro-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-4-fluorobenzamide
CID 34169732
N-(2,6-dichlorophenyl)-2-(dimethylamino)acetamide
CID 9255062
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-5-(2-fluorophenyl)furan-2-carboxamide
CID 46562764
N-(2,6-dichlorophenyl)-2-[ethyl-[2-(4-fluorophenyl)ethylcarbamoyl]amino]acetamide
CID 55457102

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide?
The IUPAC name of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide (CID 86912260) is N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide is CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(COC)o1.
What is the InChIKey of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide?
The InChIKey is IZUVAQACCRCNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O4/c1-3-21(17(23)14-8-7-11(25-14)10-24-2)9-15(22)20-16-12(18)5-4-6-13(16)19/h4-8H,3,9-10H2,1-2H3,(H,20,22).
What are the key properties of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide?
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide has a molecular weight of 385.25 g/mol, XLogP of 3.83, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-5-(methoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 86912260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).