N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide

C15H13N3O2 — CID 107735760

IUPACN-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide
SMILESCN(C(=O)c1n[nH]c2ccccc12)c1cccc(O)c1
InChIInChI=1S/C15H13N3O2/c1-18(10-5-4-6-11(19)9-10)15(20)14-12-7-2-3-8-13(12)16-17-14/h2-9,19H,1H3,(H,16,17)
InChIKeyLKXSSICUTFMVQO-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.55
Rot. Bonds2

About N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide

N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide (PubChem CID 107735760) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide
PubChem CID107735760
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide
SMILESCN(C(=O)c1n[nH]c2ccccc12)c1cccc(O)c1
InChIInChI=1S/C15H13N3O2/c1-18(10-5-4-6-11(19)9-10)15(20)14-12-7-2-3-8-13(12)16-17-14/h2-9,19H,1H3,(H,16,17)
InChIKeyLKXSSICUTFMVQO-UHFFFAOYSA-N
XLogP2.55
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide?
The IUPAC name of N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide (CID 107735760) is N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide?
The canonical SMILES for N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide is CN(C(=O)c1n[nH]c2ccccc12)c1cccc(O)c1.
What is the InChIKey of N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide?
The InChIKey is LKXSSICUTFMVQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-18(10-5-4-6-11(19)9-10)15(20)14-12-7-2-3-8-13(12)16-17-14/h2-9,19H,1H3,(H,16,17).
What are the key properties of N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide?
N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide is sourced from PubChem (CID 107735760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).