N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide

C18H17N3O3S — CID 46483651

IUPACN-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
SMILESCCN(C(=O)Cc1csc(NC(=O)c2ccco2)n1)c1ccccc1
InChIInChI=1S/C18H17N3O3S/c1-2-21(14-7-4-3-5-8-14)16(22)11-13-12-25-18(19-13)20-17(23)15-9-6-10-24-15/h3-10,12H,2,11H2,1H3,(H,19,20,23)
InChIKeyGMNREMSGQJFOQO-UHFFFAOYSA-N
MW355.42 g/mol
LogP3.58
Rot. Bonds6

About N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide

N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide (PubChem CID 46483651) has the molecular formula C18H17N3O3S and a molecular weight of 355.42 g/mol. Its IUPAC name is N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
PubChem CID46483651
Molecular FormulaC18H17N3O3S
Molecular Weight355.42 g/mol
Exact Mass355.10
IUPAC NameN-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
SMILESCCN(C(=O)Cc1csc(NC(=O)c2ccco2)n1)c1ccccc1
InChIInChI=1S/C18H17N3O3S/c1-2-21(14-7-4-3-5-8-14)16(22)11-13-12-25-18(19-13)20-17(23)15-9-6-10-24-15/h3-10,12H,2,11H2,1H3,(H,19,20,23)
InChIKeyGMNREMSGQJFOQO-UHFFFAOYSA-N
XLogP3.58
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[2-oxo-2-[N-(thiophen-3-ylmethyl)anilino]ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 86878097
N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 51191452
N-(4-ethyl-1,3-thiazol-2-yl)furan-2-carboxamide
CID 87065618
N-[4-[2-oxo-2-(propylamino)ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 17472757
N-[4-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 40881647
N-[4-[2-(N-methyl-3-propan-2-ylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 47868198
N-[4-[2-[[4-(dimethylamino)phenyl]methylamino]-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 17439699
N-[4-[2-(2-methoxy-N-methylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 55888004
N-[4-[2-[(2-methyl-1-phenylpropyl)amino]-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 51213959
N-[4-[2-(4-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 17450354
N-[4-[2-[1-(2-bromophenyl)ethyl-propylamino]-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 55882220
N-[4-[2-[3-ethynyl-N-(thiophen-2-ylmethyl)anilino]-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 86887182

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide?
The IUPAC name of N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide (CID 46483651) is N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide is CCN(C(=O)Cc1csc(NC(=O)c2ccco2)n1)c1ccccc1.
What is the InChIKey of N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide?
The InChIKey is GMNREMSGQJFOQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3S/c1-2-21(14-7-4-3-5-8-14)16(22)11-13-12-25-18(19-13)20-17(23)15-9-6-10-24-15/h3-10,12H,2,11H2,1H3,(H,19,20,23).
What are the key properties of N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide?
N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide has a molecular weight of 355.42 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(N-ethylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]furan-2-carboxamide is sourced from PubChem (CID 46483651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).