N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide

C16H18N2O4 — CID 2461510

IUPACN-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1ccco1
InChIInChI=1S/C16H18N2O4/c1-3-18(16(20)14-8-5-9-22-14)11-15(19)17-12-6-4-7-13(10-12)21-2/h4-10H,3,11H2,1-2H3,(H,17,19)
InChIKeyNRARICSBGYUYGO-UHFFFAOYSA-N
MW302.33 g/mol
LogP2.39
Rot. Bonds6

About N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide

N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide (PubChem CID 2461510) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide
PubChem CID2461510
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC NameN-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1ccco1
InChIInChI=1S/C16H18N2O4/c1-3-18(16(20)14-8-5-9-22-14)11-15(19)17-12-6-4-7-13(10-12)21-2/h4-10H,3,11H2,1-2H3,(H,17,19)
InChIKeyNRARICSBGYUYGO-UHFFFAOYSA-N
XLogP2.39
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide (CID 2461510) is N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide is CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1ccco1.
What is the InChIKey of N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide?
The InChIKey is NRARICSBGYUYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-3-18(16(20)14-8-5-9-22-14)11-15(19)17-12-6-4-7-13(10-12)21-2/h4-10H,3,11H2,1-2H3,(H,17,19).
What are the key properties of N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide?
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 2461510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).