N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide

C14H13N3O3 — CID 110469584

IUPACN-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide
SMILESCOc1ccc2c(C(=O)NCc3ccco3)n[nH]c2c1
InChIInChI=1S/C14H13N3O3/c1-19-9-4-5-11-12(7-9)16-17-13(11)14(18)15-8-10-3-2-6-20-10/h2-7H,8H2,1H3,(H,15,18)(H,16,17)
InChIKeyMZZLLLGHJHDYGJ-UHFFFAOYSA-N
MW271.28 g/mol
LogP2.09
Rot. Bonds4

About N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide

N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide (PubChem CID 110469584) has the molecular formula C14H13N3O3 and a molecular weight of 271.28 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide
PubChem CID110469584
Molecular FormulaC14H13N3O3
Molecular Weight271.28 g/mol
Exact Mass271.10
IUPAC NameN-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide
SMILESCOc1ccc2c(C(=O)NCc3ccco3)n[nH]c2c1
InChIInChI=1S/C14H13N3O3/c1-19-9-4-5-11-12(7-9)16-17-13(11)14(18)15-8-10-3-2-6-20-10/h2-7H,8H2,1H3,(H,15,18)(H,16,17)
InChIKeyMZZLLLGHJHDYGJ-UHFFFAOYSA-N
XLogP2.09
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide (CID 110469584) is N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide is COc1ccc2c(C(=O)NCc3ccco3)n[nH]c2c1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide?
The InChIKey is MZZLLLGHJHDYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3/c1-19-9-4-5-11-12(7-9)16-17-13(11)14(18)15-8-10-3-2-6-20-10/h2-7H,8H2,1H3,(H,15,18)(H,16,17).
What are the key properties of N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide?
N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide has a molecular weight of 271.28 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide is sourced from PubChem (CID 110469584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).