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

C19H13FN4O3S — CID 72628366

IUPAC2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2cc3c(C=Cc4cccs4)n[nH]c3cc2F)o1
InChIInChI=1S/C19H13FN4O3S/c20-12-9-14-11(13(23-24-14)4-3-10-2-1-7-28-10)8-15(12)22-19(26)17-6-5-16(27-17)18(21)25/h1-9H,(H2,21,25)(H,22,26)(H,23,24)
InChIKeyKRGWOGSOZAKNJL-UHFFFAOYSA-N
MW396.40 g/mol
LogP3.88
Rot. Bonds5

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

2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide (PubChem CID 72628366) has the molecular formula C19H13FN4O3S and a molecular weight of 396.40 g/mol. Its IUPAC name is 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide
PubChem CID72628366
Molecular FormulaC19H13FN4O3S
Molecular Weight396.40 g/mol
Exact Mass396.07
IUPAC Name2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2cc3c(C=Cc4cccs4)n[nH]c3cc2F)o1
InChIInChI=1S/C19H13FN4O3S/c20-12-9-14-11(13(23-24-14)4-3-10-2-1-7-28-10)8-15(12)22-19(26)17-6-5-16(27-17)18(21)25/h1-9H,(H2,21,25)(H,22,26)(H,23,24)
InChIKeyKRGWOGSOZAKNJL-UHFFFAOYSA-N
XLogP3.88
TPSA114.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.40
LogP ≤ 53.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide with MolForge

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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
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
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
4-fluoro-N-(furan-2-ylmethyl)-3-[(E)-2-thiophen-2-ylethenyl]-2H-indazole-5-carboxamide
CID 59797188
N-[6-fluoro-3-[(E)-2-thiophen-2-ylethenyl]-1H-indazol-5-yl]furan-2-carboxamide
CID 59797208
N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]furan-2-carboxamide
CID 60034689
2-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]furan-2,5-dicarboxamide
CID 60034706
N-[3-[(E)-2-(3,4-difluorophenyl)ethenyl]-6-fluoro-1H-indazol-5-yl]furan-2-carboxamide
CID 60034711

Frequently Asked Questions

What is the IUPAC name of 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide?
The IUPAC name of 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide (CID 72628366) is 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide.
What is the SMILES notation for 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide?
The canonical SMILES for 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide is NC(=O)c1ccc(C(=O)Nc2cc3c(C=Cc4cccs4)n[nH]c3cc2F)o1.
What is the InChIKey of 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide?
The InChIKey is KRGWOGSOZAKNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4O3S/c20-12-9-14-11(13(23-24-14)4-3-10-2-1-7-28-10)8-15(12)22-19(26)17-6-5-16(27-17)18(21)25/h1-9H,(H2,21,25)(H,22,26)(H,23,24).
What are the key properties of 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide?
2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide has a molecular weight of 396.40 g/mol, XLogP of 3.88, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2,5-dicarboxamide is sourced from PubChem (CID 72628366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).