N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide

C15H14N2O3S2 — CID 111441348

IUPACN-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide
SMILESCc1nc(-c2cc(C(=O)NCC(O)c3ccsc3)co2)cs1
InChIInChI=1S/C15H14N2O3S2/c1-9-17-12(8-22-9)14-4-11(6-20-14)15(19)16-5-13(18)10-2-3-21-7-10/h2-4,6-8,13,18H,5H2,1H3,(H,16,19)
InChIKeyQDPYJTLFQPCNNA-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.24
Rot. Bonds5

About N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide

N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide (PubChem CID 111441348) has the molecular formula C15H14N2O3S2 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide
PubChem CID111441348
Molecular FormulaC15H14N2O3S2
Molecular Weight334.42 g/mol
Exact Mass334.04
IUPAC NameN-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide
SMILESCc1nc(-c2cc(C(=O)NCC(O)c3ccsc3)co2)cs1
InChIInChI=1S/C15H14N2O3S2/c1-9-17-12(8-22-9)14-4-11(6-20-14)15(19)16-5-13(18)10-2-3-21-7-10/h2-4,6-8,13,18H,5H2,1H3,(H,16,19)
InChIKeyQDPYJTLFQPCNNA-UHFFFAOYSA-N
XLogP3.24
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-hydroxybutyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide
CID 111433798
N-(2-hydroxy-2-thiophen-3-ylethyl)-6-oxopyran-3-carboxamide
CID 106436177
N-(2-hydroxy-2-thiophen-3-ylethyl)-3,4-dimethylbenzamide
CID 90496462
3-hydroxy-N-(2-hydroxy-2-thiophen-3-ylethyl)-5-methylbenzamide
CID 111578613
4-ethyl-N-(2-hydroxy-2-thiophen-3-ylethyl)benzamide
CID 90496459
N-(2-hydroxy-2-thiophen-3-ylethyl)pyridine-4-carboxamide
CID 103686115
N-(2-hydroxy-2-thiophen-3-ylethyl)-2,1,3-benzothiadiazole-5-carboxamide
CID 52992616
N-(2-hydroxy-2-thiophen-3-ylethyl)-3,5-dimethoxybenzamide
CID 90496493
N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide
CID 86957867
N-(2-hydroxy-2-thiophen-3-ylethyl)-3-propan-2-ylthiophene-2-carboxamide
CID 111441647
N-(2-hydroxy-2-thiophen-3-ylethyl)quinoline-6-carboxamide
CID 103686077
2-ethoxy-N-(2-hydroxy-2-thiophen-3-ylethyl)acetamide
CID 103771707

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide?
The IUPAC name of N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide (CID 111441348) is N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide is Cc1nc(-c2cc(C(=O)NCC(O)c3ccsc3)co2)cs1.
What is the InChIKey of N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide?
The InChIKey is QDPYJTLFQPCNNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3S2/c1-9-17-12(8-22-9)14-4-11(6-20-14)15(19)16-5-13(18)10-2-3-21-7-10/h2-4,6-8,13,18H,5H2,1H3,(H,16,19).
What are the key properties of N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide?
N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-thiophen-3-ylethyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-3-carboxamide is sourced from PubChem (CID 111441348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).