3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide

C19H14N4O3 — CID 22479833

IUPAC3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]nc(-c3cccc(NC(=O)c4ccco4)c3)c2c1
InChIInChI=1S/C19H14N4O3/c20-18(24)12-6-7-15-14(10-12)17(23-22-15)11-3-1-4-13(9-11)21-19(25)16-5-2-8-26-16/h1-10H,(H2,20,24)(H,21,25)(H,22,23)
InChIKeyKBWJAIGJHDMZIZ-UHFFFAOYSA-N
MW346.35 g/mol
LogP3.17
Rot. Bonds4

About 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide

3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide (PubChem CID 22479833) has the molecular formula C19H14N4O3 and a molecular weight of 346.35 g/mol. Its IUPAC name is 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide
PubChem CID22479833
Molecular FormulaC19H14N4O3
Molecular Weight346.35 g/mol
Exact Mass346.11
IUPAC Name3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]nc(-c3cccc(NC(=O)c4ccco4)c3)c2c1
InChIInChI=1S/C19H14N4O3/c20-18(24)12-6-7-15-14(10-12)17(23-22-15)11-3-1-4-13(9-11)21-19(25)16-5-2-8-26-16/h1-10H,(H2,20,24)(H,21,25)(H,22,23)
InChIKeyKBWJAIGJHDMZIZ-UHFFFAOYSA-N
XLogP3.17
TPSA114.01 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.35
LogP ≤ 53.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide?
The IUPAC name of 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide (CID 22479833) is 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide.
What is the SMILES notation for 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide?
The canonical SMILES for 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide is NC(=O)c1ccc2[nH]nc(-c3cccc(NC(=O)c4ccco4)c3)c2c1.
What is the InChIKey of 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide?
The InChIKey is KBWJAIGJHDMZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O3/c20-18(24)12-6-7-15-14(10-12)17(23-22-15)11-3-1-4-13(9-11)21-19(25)16-5-2-8-26-16/h1-10H,(H2,20,24)(H,21,25)(H,22,23).
What are the key properties of 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide?
3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide has a molecular weight of 346.35 g/mol, XLogP of 3.17, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(furan-2-carbonylamino)phenyl]-1H-indazole-5-carboxamide is sourced from PubChem (CID 22479833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).