N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide

C13H11N3O2 — CID 9119858

IUPACN-(furan-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESO=C(NCc1ccco1)c1n[nH]c2ccccc12
InChIInChI=1S/C13H11N3O2/c17-13(14-8-9-4-3-7-18-9)12-10-5-1-2-6-11(10)15-16-12/h1-7H,8H2,(H,14,17)(H,15,16)
InChIKeyMGITVMOEUWYLEM-UHFFFAOYSA-N
MW241.25 g/mol
LogP2.09
Rot. Bonds3

About N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide

N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide (PubChem CID 9119858) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1H-indazole-3-carboxamide
PubChem CID9119858
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC NameN-(furan-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESO=C(NCc1ccco1)c1n[nH]c2ccccc12
InChIInChI=1S/C13H11N3O2/c17-13(14-8-9-4-3-7-18-9)12-10-5-1-2-6-11(10)15-16-12/h1-7H,8H2,(H,14,17)(H,15,16)
InChIKeyMGITVMOEUWYLEM-UHFFFAOYSA-N
XLogP2.09
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide (CID 9119858) is N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide is O=C(NCc1ccco1)c1n[nH]c2ccccc12.
What is the InChIKey of N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide?
The InChIKey is MGITVMOEUWYLEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2/c17-13(14-8-9-4-3-7-18-9)12-10-5-1-2-6-11(10)15-16-12/h1-7H,8H2,(H,14,17)(H,15,16).
What are the key properties of N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide?
N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide has a molecular weight of 241.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 9119858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).