N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide

C16H15N3O2 — CID 16866355

IUPACN-(2-ethoxyphenyl)-1H-indazole-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C16H15N3O2/c1-2-21-14-10-6-5-9-13(14)17-16(20)15-11-7-3-4-8-12(11)18-19-15/h3-10H,2H2,1H3,(H,17,20)(H,18,19)
InChIKeyWUHJKMQDSJUQPK-UHFFFAOYSA-N
MW281.32 g/mol
LogP3.21
Rot. Bonds4

About N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide

N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide (PubChem CID 16866355) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1H-indazole-3-carboxamide
PubChem CID16866355
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC NameN-(2-ethoxyphenyl)-1H-indazole-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C16H15N3O2/c1-2-21-14-10-6-5-9-13(14)17-16(20)15-11-7-3-4-8-12(11)18-19-15/h3-10H,2H2,1H3,(H,17,20)(H,18,19)
InChIKeyWUHJKMQDSJUQPK-UHFFFAOYSA-N
XLogP3.21
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide (CID 16866355) is N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide is CCOc1ccccc1NC(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide?
The InChIKey is WUHJKMQDSJUQPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-2-21-14-10-6-5-9-13(14)17-16(20)15-11-7-3-4-8-12(11)18-19-15/h3-10H,2H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide?
N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide has a molecular weight of 281.32 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 16866355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).