2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide

C19H23N3O3 — CID 11958393

IUPAC2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide
SMILESCCCCn1nc2cc(C(=O)NCc3ccco3)ccc2c1OCC
InChIInChI=1S/C19H23N3O3/c1-3-5-10-22-19(24-4-2)16-9-8-14(12-17(16)21-22)18(23)20-13-15-7-6-11-25-15/h6-9,11-12H,3-5,10,13H2,1-2H3,(H,20,23)
InChIKeyKLCZUTHBIKPLMC-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.76
Rot. Bonds8

About 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide

2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide (PubChem CID 11958393) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide.

Molecular Properties

Compound Name2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide
PubChem CID11958393
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide
SMILESCCCCn1nc2cc(C(=O)NCc3ccco3)ccc2c1OCC
InChIInChI=1S/C19H23N3O3/c1-3-5-10-22-19(24-4-2)16-9-8-14(12-17(16)21-22)18(23)20-13-15-7-6-11-25-15/h6-9,11-12H,3-5,10,13H2,1-2H3,(H,20,23)
InChIKeyKLCZUTHBIKPLMC-UHFFFAOYSA-N
XLogP3.76
TPSA69.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-ethoxy-N-(furan-2-ylmethyl)-2-propylindazole-6-carboxamide
CID 71425610
2-butyl-N-(cyclopropylmethyl)-3-ethoxyindazole-6-carboxamide
CID 11958407
2-butyl-3-ethoxy-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide
CID 11958408
3-ethoxy-N-(furan-2-ylmethyl)-4-methoxybenzamide
CID 35808851
2,3-diethyl-N-(furan-2-ylmethyl)quinoxaline-6-carboxamide
CID 2302300
N-(furan-2-ylmethyl)-4-heptoxybenzamide
CID 3131904
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261
N-(furan-2-ylmethyl)-3-methylbenzamide
CID 796307
2-[(2-fluorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-4-oxo-3-pentylquinazoline-7-carboxamide
CID 4149966
N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide
CID 62172710
3-bromo-N-(furan-2-ylmethyl)-4-methylbenzamide
CID 935017
2-chloro-N-(furan-2-ylmethyl)-3-methylbenzimidazole-5-carboxamide
CID 100788712

Frequently Asked Questions

What is the IUPAC name of 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide?
The IUPAC name of 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide (CID 11958393) is 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide.
What is the SMILES notation for 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide?
The canonical SMILES for 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide is CCCCn1nc2cc(C(=O)NCc3ccco3)ccc2c1OCC.
What is the InChIKey of 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide?
The InChIKey is KLCZUTHBIKPLMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-3-5-10-22-19(24-4-2)16-9-8-14(12-17(16)21-22)18(23)20-13-15-7-6-11-25-15/h6-9,11-12H,3-5,10,13H2,1-2H3,(H,20,23).
What are the key properties of 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide?
2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-3-ethoxy-N-(furan-2-ylmethyl)indazole-6-carboxamide is sourced from PubChem (CID 11958393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).