N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide

C12H8FN3O2 — CID 100698185

IUPACN-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide
SMILESO=C(Nc1n[nH]c2cc(F)ccc12)c1ccoc1
InChIInChI=1S/C12H8FN3O2/c13-8-1-2-9-10(5-8)15-16-11(9)14-12(17)7-3-4-18-6-7/h1-6H,(H2,14,15,16,17)
InChIKeyLMOZSGZCFLXYKS-UHFFFAOYSA-N
MW245.21 g/mol
LogP2.55
Rot. Bonds2

About N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide

N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide (PubChem CID 100698185) has the molecular formula C12H8FN3O2 and a molecular weight of 245.21 g/mol. Its IUPAC name is N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide
PubChem CID100698185
Molecular FormulaC12H8FN3O2
Molecular Weight245.21 g/mol
Exact Mass245.06
IUPAC NameN-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide
SMILESO=C(Nc1n[nH]c2cc(F)ccc12)c1ccoc1
InChIInChI=1S/C12H8FN3O2/c13-8-1-2-9-10(5-8)15-16-11(9)14-12(17)7-3-4-18-6-7/h1-6H,(H2,14,15,16,17)
InChIKeyLMOZSGZCFLXYKS-UHFFFAOYSA-N
XLogP2.55
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.21
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide?
The IUPAC name of N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide (CID 100698185) is N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide.
What is the SMILES notation for N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide?
The canonical SMILES for N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide is O=C(Nc1n[nH]c2cc(F)ccc12)c1ccoc1.
What is the InChIKey of N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide?
The InChIKey is LMOZSGZCFLXYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN3O2/c13-8-1-2-9-10(5-8)15-16-11(9)14-12(17)7-3-4-18-6-7/h1-6H,(H2,14,15,16,17).
What are the key properties of N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide?
N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide has a molecular weight of 245.21 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-1H-indazol-3-yl)furan-3-carboxamide is sourced from PubChem (CID 100698185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).