N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide

C22H14FN3O2 — CID 23589937

IUPACN-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide
SMILESO=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1F)c1ccco1
InChIInChI=1S/C22H14FN3O2/c23-20-17(24-22(27)18-6-3-11-28-18)10-9-16-19(20)21(26-25-16)15-8-7-13-4-1-2-5-14(13)12-15/h1-12H,(H,24,27)(H,25,26)
InChIKeyCRZGSVBYEMOGDI-UHFFFAOYSA-N
MW371.37 g/mol
LogP5.37
Rot. Bonds3

About N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide

N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide (PubChem CID 23589937) has the molecular formula C22H14FN3O2 and a molecular weight of 371.37 g/mol. Its IUPAC name is N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide
PubChem CID23589937
Molecular FormulaC22H14FN3O2
Molecular Weight371.37 g/mol
Exact Mass371.11
IUPAC NameN-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide
SMILESO=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1F)c1ccco1
InChIInChI=1S/C22H14FN3O2/c23-20-17(24-22(27)18-6-3-11-28-18)10-9-16-19(20)21(26-25-16)15-8-7-13-4-1-2-5-14(13)12-15/h1-12H,(H,24,27)(H,25,26)
InChIKeyCRZGSVBYEMOGDI-UHFFFAOYSA-N
XLogP5.37
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.37
LogP ≤ 55.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide?
The IUPAC name of N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide (CID 23589937) is N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide.
What is the SMILES notation for N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide?
The canonical SMILES for N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide is O=C(Nc1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1F)c1ccco1.
What is the InChIKey of N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide?
The InChIKey is CRZGSVBYEMOGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14FN3O2/c23-20-17(24-22(27)18-6-3-11-28-18)10-9-16-19(20)21(26-25-16)15-8-7-13-4-1-2-5-14(13)12-15/h1-12H,(H,24,27)(H,25,26).
What are the key properties of N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide?
N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide has a molecular weight of 371.37 g/mol, XLogP of 5.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide is sourced from PubChem (CID 23589937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).