2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide

C16H15N5O3 — CID 138458852

IUPAC2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide
SMILESCOc1ccc(O)c(C(=O)Nc2cccc(-c3nncn3C)n2)c1
InChIInChI=1S/C16H15N5O3/c1-21-9-17-20-15(21)12-4-3-5-14(18-12)19-16(23)11-8-10(24-2)6-7-13(11)22/h3-9,22H,1-2H3,(H,18,19,23)
InChIKeyJXPPUFOYBUUQJD-UHFFFAOYSA-N
MW325.33 g/mol
LogP1.84
Rot. Bonds4

About 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide

2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide (PubChem CID 138458852) has the molecular formula C16H15N5O3 and a molecular weight of 325.33 g/mol. Its IUPAC name is 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide
PubChem CID138458852
Molecular FormulaC16H15N5O3
Molecular Weight325.33 g/mol
Exact Mass325.12
IUPAC Name2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide
SMILESCOc1ccc(O)c(C(=O)Nc2cccc(-c3nncn3C)n2)c1
InChIInChI=1S/C16H15N5O3/c1-21-9-17-20-15(21)12-4-3-5-14(18-12)19-16(23)11-8-10(24-2)6-7-13(11)22/h3-9,22H,1-2H3,(H,18,19,23)
InChIKeyJXPPUFOYBUUQJD-UHFFFAOYSA-N
XLogP1.84
TPSA102.16 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-amino-5-(2-methoxyethoxy)-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide
CID 156635533
2-fluoro-5-(2-methoxypyrimidin-4-yl)oxy-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide
CID 135348193
N-(5-ethyl-1H-pyrazol-3-yl)-2-hydroxy-5-methoxybenzamide
CID 112687144
5-methoxy-2-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]-3H-1,2-benzothiazole-6-carboxamide
CID 148895181
N-[6-[4-[(2S)-1,1-difluoropropan-2-yl]-1,2,4-triazol-3-yl]-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide
CID 146381600
3-methoxy-1-methyl-N-[6-[4-[(3R)-oxolan-3-yl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyrazole-4-carboxamide
CID 146381583
N-(2-chloro-6-methylphenyl)-2-hydroxy-5-methoxybenzamide
CID 66255339
2-hydroxy-5-methoxy-N-(4-methoxy-6-methylpyrimidin-2-yl)benzamide
CID 107600817
2-hydroxy-5-methoxy-N-(3-methyl-1,2,4-oxadiazol-5-yl)benzamide
CID 115589350
3-ethoxy-N-[6-(4-ethyl-1,2,4-triazol-3-yl)-2-pyridinyl]-1-methylpyrazole-4-carboxamide
CID 146393281
2-fluoro-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide
CID 155521986
2-hydroxy-5-methoxy-N-(4-methyl-1H-pyrazol-5-yl)benzamide
CID 112691144

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide?
The IUPAC name of 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide (CID 138458852) is 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide.
What is the SMILES notation for 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide?
The canonical SMILES for 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide is COc1ccc(O)c(C(=O)Nc2cccc(-c3nncn3C)n2)c1.
What is the InChIKey of 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide?
The InChIKey is JXPPUFOYBUUQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O3/c1-21-9-17-20-15(21)12-4-3-5-14(18-12)19-16(23)11-8-10(24-2)6-7-13(11)22/h3-9,22H,1-2H3,(H,18,19,23).
What are the key properties of 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide?
2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide has a molecular weight of 325.33 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methoxy-N-[6-(4-methyl-1,2,4-triazol-3-yl)-2-pyridinyl]benzamide is sourced from PubChem (CID 138458852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).