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

C13H11N3O2 — CID 20951967

IUPACN-(furan-2-ylmethyl)-1H-indazole-6-carboxamide
SMILESO=C(NCc1ccco1)c1ccc2cn[nH]c2c1
InChIInChI=1S/C13H11N3O2/c17-13(14-8-11-2-1-5-18-11)9-3-4-10-7-15-16-12(10)6-9/h1-7H,8H2,(H,14,17)(H,15,16)
InChIKeySYUNSUIQGPLELD-UHFFFAOYSA-N
MW241.25 g/mol
LogP2.09
Rot. Bonds3

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

N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide (PubChem CID 20951967) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1H-indazole-6-carboxamide
PubChem CID20951967
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC NameN-(furan-2-ylmethyl)-1H-indazole-6-carboxamide
SMILESO=C(NCc1ccco1)c1ccc2cn[nH]c2c1
InChIInChI=1S/C13H11N3O2/c17-13(14-8-11-2-1-5-18-11)9-3-4-10-7-15-16-12(10)6-9/h1-7H,8H2,(H,14,17)(H,15,16)
InChIKeySYUNSUIQGPLELD-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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Related Compounds

US10023564, Example 32
CID 118888920
US10023564, Example 35
CID 118888927
6-(Furan-2-yl)-1H-indazole
CID 53408421
2H-Indazole-6-carboxamide, 2-butyl-3-ethoxy-N-(2-furanylmethyl)-
CID 11958393
N-(1-(furan-2-ylmethyl)piperidin-3-yl)-1H-indazol-5-amine
CID 44421868
N-(furan-2-ylmethyl)-2-(1H-indazol-3-yl)-N-methyl-1H-indole-6-carboxamide
CID 136188809
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 1H-indazole-3-carboxylate
CID 2087463
N-(furan-2-ylmethyl)-5-phenyl-1H-pyrazole-3-carboxamide
CID 8867965
3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide
CID 11958391
2H-Indazole-6-carboxamide, 3-ethoxy-2-ethyl-N-(2-furanylmethyl)-
CID 11958697
6-bromo-N-(furan-2-ylmethyl)-1H-indazol-4-amine
CID 146669497
3-[3-(2-Furylcarbonylamino)Phenyl]-1H-Indazole-5-Carboxamide
CID 22479833

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide (CID 20951967) is N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide is O=C(NCc1ccco1)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide?
The InChIKey is SYUNSUIQGPLELD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2/c17-13(14-8-11-2-1-5-18-11)9-3-4-10-7-15-16-12(10)6-9/h1-7H,8H2,(H,14,17)(H,15,16).
What are the key properties of N-(furan-2-ylmethyl)-1H-indazole-6-carboxamide?
N-(furan-2-ylmethyl)-1H-indazole-6-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-6-carboxamide is sourced from PubChem (CID 20951967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).