N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide

C18H16FNO2S — CID 134014500

IUPACN-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1ccc(-c2ccccc2F)o1
InChIInChI=1S/C18H16FNO2S/c1-2-20(12-13-6-5-11-23-13)18(21)17-10-9-16(22-17)14-7-3-4-8-15(14)19/h3-11H,2,12H2,1H3
InChIKeyXZCHAPGUKDLMFD-UHFFFAOYSA-N
MW329.40 g/mol
LogP4.81
Rot. Bonds5

About N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide

N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide (PubChem CID 134014500) has the molecular formula C18H16FNO2S and a molecular weight of 329.40 g/mol. Its IUPAC name is N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide
PubChem CID134014500
Molecular FormulaC18H16FNO2S
Molecular Weight329.40 g/mol
Exact Mass329.09
IUPAC NameN-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide
SMILESCCN(Cc1cccs1)C(=O)c1ccc(-c2ccccc2F)o1
InChIInChI=1S/C18H16FNO2S/c1-2-20(12-13-6-5-11-23-13)18(21)17-10-9-16(22-17)14-7-3-4-8-15(14)19/h3-11H,2,12H2,1H3
InChIKeyXZCHAPGUKDLMFD-UHFFFAOYSA-N
XLogP4.81
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-5-(2-fluorophenyl)furan-2-carboxamide
CID 46562764
2-amino-N-ethyl-3-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 62660536
N-ethyl-4-fluoro-N-(thiophen-2-ylmethyl)benzamide
CID 60655445
5-(2-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylfuran-2-carboxamide
CID 109388419
N-butyl-5-(2-fluorophenyl)-N-methylfuran-2-carboxamide
CID 78800671
5-(2-fluorophenyl)-N-methoxy-N-methylfuran-2-carboxamide
CID 78797464
N-ethyl-2-fluoro-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 79770274
4-chloro-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 78801917
N-ethyl-2-fluoro-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 107358620
N-ethyl-4-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 134014370
5-(2-fluorophenyl)-N-piperidin-4-yl-N-propylfuran-2-carboxamide
CID 119823505
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-3-carboxamide
CID 60659716

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The IUPAC name of N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide (CID 134014500) is N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The canonical SMILES for N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide is CCN(Cc1cccs1)C(=O)c1ccc(-c2ccccc2F)o1.
What is the InChIKey of N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The InChIKey is XZCHAPGUKDLMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FNO2S/c1-2-20(12-13-6-5-11-23-13)18(21)17-10-9-16(22-17)14-7-3-4-8-15(14)19/h3-11H,2,12H2,1H3.
What are the key properties of N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 4.81, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(2-fluorophenyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 134014500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).