N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide

C20H14N4O2 — CID 44540422

IUPACN-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide
SMILESO=C(Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12)c1ccoc1
InChIInChI=1S/C20H14N4O2/c25-20(12-5-7-26-11-12)23-18-8-13(9-19-16(18)10-22-24-19)14-2-1-3-17-15(14)4-6-21-17/h1-11,21H,(H,22,24)(H,23,25)
InChIKeyZTNGKWDKCNNVHD-UHFFFAOYSA-N
MW342.36 g/mol
LogP4.56
Rot. Bonds3

About N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide

N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide (PubChem CID 44540422) has the molecular formula C20H14N4O2 and a molecular weight of 342.36 g/mol. Its IUPAC name is N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide
PubChem CID44540422
Molecular FormulaC20H14N4O2
Molecular Weight342.36 g/mol
Exact Mass342.11
IUPAC NameN-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide
SMILESO=C(Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12)c1ccoc1
InChIInChI=1S/C20H14N4O2/c25-20(12-5-7-26-11-12)23-18-8-13(9-19-16(18)10-22-24-19)14-2-1-3-17-15(14)4-6-21-17/h1-11,21H,(H,22,24)(H,23,25)
InChIKeyZTNGKWDKCNNVHD-UHFFFAOYSA-N
XLogP4.56
TPSA86.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.36
LogP ≤ 54.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide?
The IUPAC name of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide (CID 44540422) is N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide.
What is the SMILES notation for N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide?
The canonical SMILES for N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide is O=C(Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12)c1ccoc1.
What is the InChIKey of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide?
The InChIKey is ZTNGKWDKCNNVHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4O2/c25-20(12-5-7-26-11-12)23-18-8-13(9-19-16(18)10-22-24-19)14-2-1-3-17-15(14)4-6-21-17/h1-11,21H,(H,22,24)(H,23,25).
What are the key properties of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide?
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide has a molecular weight of 342.36 g/mol, XLogP of 4.56, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]furan-3-carboxamide is sourced from PubChem (CID 44540422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).