N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide

C15H16FNO3 — CID 60652216

IUPACN-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCCN(Cc1ccc(OC)c(F)c1)C(=O)c1ccco1
InChIInChI=1S/C15H16FNO3/c1-3-17(15(18)14-5-4-8-20-14)10-11-6-7-13(19-2)12(16)9-11/h4-9H,3,10H2,1-2H3
InChIKeyFKPJBPQIQWXBLQ-UHFFFAOYSA-N
MW277.30 g/mol
LogP3.09
Rot. Bonds5

About N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide

N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide (PubChem CID 60652216) has the molecular formula C15H16FNO3 and a molecular weight of 277.30 g/mol. Its IUPAC name is N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide
PubChem CID60652216
Molecular FormulaC15H16FNO3
Molecular Weight277.30 g/mol
Exact Mass277.11
IUPAC NameN-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCCN(Cc1ccc(OC)c(F)c1)C(=O)c1ccco1
InChIInChI=1S/C15H16FNO3/c1-3-17(15(18)14-5-4-8-20-14)10-11-6-7-13(19-2)12(16)9-11/h4-9H,3,10H2,1-2H3
InChIKeyFKPJBPQIQWXBLQ-UHFFFAOYSA-N
XLogP3.09
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.30
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-1-benzofuran-2-carboxamide
CID 9462623
2-amino-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]acetamide
CID 60712583
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]quinoline-2-carboxamide
CID 18115688
2-amino-N,2-diethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]butanamide
CID 79814219
4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide
CID 18115738
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-(methylamino)propanamide
CID 55096948
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 62847075
N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-3-(furan-2-yl)propanamide
CID 78808448
N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethylfuran-2-carboxamide
CID 6485239
4-acetyl-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
CID 18115687
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-(propylsulfonylamino)benzamide
CID 25331324
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-4-(prop-2-enylsulfamoyl)benzamide
CID 18115747

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide?
The IUPAC name of N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide (CID 60652216) is N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide is CCN(Cc1ccc(OC)c(F)c1)C(=O)c1ccco1.
What is the InChIKey of N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide?
The InChIKey is FKPJBPQIQWXBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO3/c1-3-17(15(18)14-5-4-8-20-14)10-11-6-7-13(19-2)12(16)9-11/h4-9H,3,10H2,1-2H3.
What are the key properties of N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide?
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide has a molecular weight of 277.30 g/mol, XLogP of 3.09, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 60652216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).