N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide

C18H12FN3O2S — CID 72564535

IUPACN-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide
SMILESO=C(Nc1cc2c(C=Cc3cccs3)n[nH]c2cc1F)c1ccco1
InChIInChI=1S/C18H12FN3O2S/c19-13-10-15-12(9-16(13)20-18(23)17-4-1-7-24-17)14(21-22-15)6-5-11-3-2-8-25-11/h1-10H,(H,20,23)(H,21,22)
InChIKeyDBSQZDJNZRQIJI-UHFFFAOYSA-N
MW353.38 g/mol
LogP4.78
Rot. Bonds4

About N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide

N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide (PubChem CID 72564535) has the molecular formula C18H12FN3O2S and a molecular weight of 353.38 g/mol. Its IUPAC name is N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide
PubChem CID72564535
Molecular FormulaC18H12FN3O2S
Molecular Weight353.38 g/mol
Exact Mass353.06
IUPAC NameN-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide
SMILESO=C(Nc1cc2c(C=Cc3cccs3)n[nH]c2cc1F)c1ccco1
InChIInChI=1S/C18H12FN3O2S/c19-13-10-15-12(9-16(13)20-18(23)17-4-1-7-24-17)14(21-22-15)6-5-11-3-2-8-25-11/h1-10H,(H,20,23)(H,21,22)
InChIKeyDBSQZDJNZRQIJI-UHFFFAOYSA-N
XLogP4.78
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-thiophen-3-yl-1,4-dihydroindeno[2,1-d]pyrazol-5-yl)furan-2-carboxamide
CID 44440250
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]furan-2-carboxamide
CID 22479877
N-[3-(1-benzofuran-2-yl)-4-fluoro-1H-indazol-5-yl]-2-thiophen-2-ylacetamide
CID 22260745
3-(1-benzothiophen-2-yl)-4-fluoro-N-(furan-2-ylmethyl)-1H-indazole-5-carboxamide
CID 23589745
3-(1-benzothiophen-2-yl)-6-fluoro-N-(furan-2-ylmethyl)-1H-indazole-5-carboxamide
CID 23589759
N-[3-(1-benzofuran-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide
CID 23589915
N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide
CID 23589919
N-[3-(1-benzothiophen-2-yl)-6-fluoro-1H-indazol-5-yl]furan-2-carboxamide
CID 23589928
N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide
CID 23589937
N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide
CID 23589948
6-fluoro-N-(furan-2-ylmethyl)-3-[(E)-2-thiophen-2-ylethenyl]-1H-indazole-5-carboxamide
CID 59796938
N-[6-fluoro-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-indazol-5-yl]furan-2-carboxamide
CID 59797061

Frequently Asked Questions

What is the IUPAC name of N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide?
The IUPAC name of N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide (CID 72564535) is N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide.
What is the SMILES notation for N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide?
The canonical SMILES for N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide is O=C(Nc1cc2c(C=Cc3cccs3)n[nH]c2cc1F)c1ccco1.
What is the InChIKey of N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide?
The InChIKey is DBSQZDJNZRQIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN3O2S/c19-13-10-15-12(9-16(13)20-18(23)17-4-1-7-24-17)14(21-22-15)6-5-11-3-2-8-25-11/h1-10H,(H,20,23)(H,21,22).
What are the key properties of N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide?
N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 4.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide is sourced from PubChem (CID 72564535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).