5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide

C17H14FNO2S — CID 18111307

IUPAC5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCc1ccco1)c1ccc(-c2ccc(F)cc2)s1
InChIInChI=1S/C17H14FNO2S/c18-13-5-3-12(4-6-13)15-7-8-16(22-15)17(20)19-10-9-14-2-1-11-21-14/h1-8,11H,9-10H2,(H,19,20)
InChIKeyBHMTZDAHYUSZTF-UHFFFAOYSA-N
MW315.37 g/mol
LogP4.12
Rot. Bonds5

About 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide

5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide (PubChem CID 18111307) has the molecular formula C17H14FNO2S and a molecular weight of 315.37 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide
PubChem CID18111307
Molecular FormulaC17H14FNO2S
Molecular Weight315.37 g/mol
Exact Mass315.07
IUPAC Name5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCc1ccco1)c1ccc(-c2ccc(F)cc2)s1
InChIInChI=1S/C17H14FNO2S/c18-13-5-3-12(4-6-13)15-7-8-16(22-15)17(20)19-10-9-14-2-1-11-21-14/h1-8,11H,9-10H2,(H,19,20)
InChIKeyBHMTZDAHYUSZTF-UHFFFAOYSA-N
XLogP4.12
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(furan-2-ylmethylamino)-2-oxoethyl] 5-(4-fluorophenyl)thiophene-2-carboxylate
CID 18192437
5-(4-fluorophenyl)-N-(furan-2-ylmethyl)-N-methylthiophene-2-carboxamide
CID 18109835
5-(4-bromophenyl)-N-(furan-2-ylmethyl)thiophene-2-carboxamide
CID 38404678
5-(4-fluorophenyl)-N-(2-pyridin-3-ylethyl)thiophene-2-carboxamide
CID 24661243
6-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 66497779
5-(4-fluorophenyl)-N-[3-(methylamino)propyl]thiophene-2-carboxamide;hydrochloride
CID 119429577
5-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 35008485
5-(4-fluorophenyl)-N-(3-methylsulfanylpropyl)thiophene-2-carboxamide
CID 71958546
5-fluoro-N-[2-(furan-2-yl)ethyl]-2-hydroxybenzamide
CID 79883377
N-[2-(furan-2-yl)ethyl]-4-methylbenzamide
CID 5305680
4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide
CID 61140224
ethyl 4-[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]butanoate
CID 37258738

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide (CID 18111307) is 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide is O=C(NCCc1ccco1)c1ccc(-c2ccc(F)cc2)s1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide?
The InChIKey is BHMTZDAHYUSZTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2S/c18-13-5-3-12(4-6-13)15-7-8-16(22-15)17(20)19-10-9-14-2-1-11-21-14/h1-8,11H,9-10H2,(H,19,20).
What are the key properties of 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide?
5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide has a molecular weight of 315.37 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[2-(furan-2-yl)ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 18111307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).