6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide

C16H15N3O2 — CID 135567294

IUPAC6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide
SMILESCCc1cc(O)ccc1-c1ccc2c(C(N)=O)n[nH]c2c1
InChIInChI=1S/C16H15N3O2/c1-2-9-7-11(20)4-6-12(9)10-3-5-13-14(8-10)18-19-15(13)16(17)21/h3-8,20H,2H2,1H3,(H2,17,21)(H,18,19)
InChIKeyMSKMVINDTCVTEK-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.60
Rot. Bonds3

About 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide

6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide (PubChem CID 135567294) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide
PubChem CID135567294
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide
SMILESCCc1cc(O)ccc1-c1ccc2c(C(N)=O)n[nH]c2c1
InChIInChI=1S/C16H15N3O2/c1-2-9-7-11(20)4-6-12(9)10-3-5-13-14(8-10)18-19-15(13)16(17)21/h3-8,20H,2H2,1H3,(H2,17,21)(H,18,19)
InChIKeyMSKMVINDTCVTEK-UHFFFAOYSA-N
XLogP2.60
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[(2-hydroxynaphthalen-1-yl)methylidene]-3-(naphthalen-2-yl)-1H-pyrazole-5-carbohydrazide
CID 135515522
5-(2-hydroxy-4,5-dimethylphenyl)-N-(3-methylphenyl)-1H-pyrazole-3-carboxamide
CID 1848114
N-(2,5-dimethylphenyl)-3-(2-hydroxy-4,5-dimethylphenyl)-1H-pyrazole-5-carboxamide
CID 1964081
N-(2,5-dimethylphenyl)-5-(2-hydroxy-4-methylphenyl)-1H-pyrazole-3-carboxamide
CID 666577
6-(2-ethyl-4-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide
CID 137651710
4-[3-(4-hydroxyphenyl)-1H-indazol-6-yl]phenol
CID 166632081
N-(2,5-dimethylphenyl)-3-(2-hydroxy-4,6-dimethylphenyl)-1H-pyrazole-5-carboxamide
CID 1862155
N-(3,4-dimethylphenyl)-5-(2-hydroxy-4,5-dimethylphenyl)-1H-pyrazole-3-carboxamide
CID 2038321
N'-[(2-hydroxy-1-naphthyl)methylene]-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 135411740
3-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol
CID 21877386
4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol
CID 135839305
N-cyclopropyl-6-(4-hydroxyphenyl)-1H-indazole-3-carboxamide
CID 137631690

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide?
The IUPAC name of 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide (CID 135567294) is 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide?
The canonical SMILES for 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide is CCc1cc(O)ccc1-c1ccc2c(C(N)=O)n[nH]c2c1.
What is the InChIKey of 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide?
The InChIKey is MSKMVINDTCVTEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-2-9-7-11(20)4-6-12(9)10-3-5-13-14(8-10)18-19-15(13)16(17)21/h3-8,20H,2H2,1H3,(H2,17,21)(H,18,19).
What are the key properties of 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide?
6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide has a molecular weight of 281.32 g/mol, XLogP of 2.60, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethyl-4-hydroxyphenyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 135567294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).