2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide

C18H15N3O2S — CID 36655716

IUPAC2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1csc(-c2ccco2)n1
InChIInChI=1S/C18H15N3O2S/c22-17(15-11-24-18(21-15)16-6-3-9-23-16)19-8-7-12-10-20-14-5-2-1-4-13(12)14/h1-6,9-11,20H,7-8H2,(H,19,22)
InChIKeyHGLJMXNLPPHGIR-UHFFFAOYSA-N
MW337.40 g/mol
LogP3.86
Rot. Bonds5

About 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide

2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide (PubChem CID 36655716) has the molecular formula C18H15N3O2S and a molecular weight of 337.40 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide
PubChem CID36655716
Molecular FormulaC18H15N3O2S
Molecular Weight337.40 g/mol
Exact Mass337.09
IUPAC Name2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1csc(-c2ccco2)n1
InChIInChI=1S/C18H15N3O2S/c22-17(15-11-24-18(21-15)16-6-3-9-23-16)19-8-7-12-10-20-14-5-2-1-4-13(12)14/h1-6,9-11,20H,7-8H2,(H,19,22)
InChIKeyHGLJMXNLPPHGIR-UHFFFAOYSA-N
XLogP3.86
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide (CID 36655716) is 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide is O=C(NCCc1c[nH]c2ccccc12)c1csc(-c2ccco2)n1.
What is the InChIKey of 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide?
The InChIKey is HGLJMXNLPPHGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2S/c22-17(15-11-24-18(21-15)16-6-3-9-23-16)19-8-7-12-10-20-14-5-2-1-4-13(12)14/h1-6,9-11,20H,7-8H2,(H,19,22).
What are the key properties of 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide has a molecular weight of 337.40 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 36655716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).