6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide

C15H13N3O3 — CID 177176482

IUPAC6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide
SMILESCn1ncc2cc(C(N)=O)c(Oc3ccc(O)cc3)cc21
InChIInChI=1S/C15H13N3O3/c1-18-13-7-14(21-11-4-2-10(19)3-5-11)12(15(16)20)6-9(13)8-17-18/h2-8,19H,1H3,(H2,16,20)
InChIKeyCHDODZIUUMSJOD-UHFFFAOYSA-N
MW283.29 g/mol
LogP2.17
Rot. Bonds3

About 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide

6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide (PubChem CID 177176482) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide.

Molecular Properties

Compound Name6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide
PubChem CID177176482
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide
SMILESCn1ncc2cc(C(N)=O)c(Oc3ccc(O)cc3)cc21
InChIInChI=1S/C15H13N3O3/c1-18-13-7-14(21-11-4-2-10(19)3-5-11)12(15(16)20)6-9(13)8-17-18/h2-8,19H,1H3,(H2,16,20)
InChIKeyCHDODZIUUMSJOD-UHFFFAOYSA-N
XLogP2.17
TPSA90.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide?
The IUPAC name of 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide (CID 177176482) is 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide.
What is the SMILES notation for 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide?
The canonical SMILES for 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide is Cn1ncc2cc(C(N)=O)c(Oc3ccc(O)cc3)cc21.
What is the InChIKey of 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide?
The InChIKey is CHDODZIUUMSJOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c1-18-13-7-14(21-11-4-2-10(19)3-5-11)12(15(16)20)6-9(13)8-17-18/h2-8,19H,1H3,(H2,16,20).
What are the key properties of 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide?
6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide has a molecular weight of 283.29 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxyphenoxy)-1-methylindazole-5-carboxamide is sourced from PubChem (CID 177176482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).