2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide

C14H17N3O2 — CID 104693761

IUPAC2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
SMILESCc1cccc(C(=O)NCCc2ccnn2C)c1O
InChIInChI=1S/C14H17N3O2/c1-10-4-3-5-12(13(10)18)14(19)15-8-6-11-7-9-16-17(11)2/h3-5,7,9,18H,6,8H2,1-2H3,(H,15,19)
InChIKeyLZGFYVJYBQADLQ-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.41
Rot. Bonds4

About 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide

2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide (PubChem CID 104693761) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
PubChem CID104693761
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
SMILESCc1cccc(C(=O)NCCc2ccnn2C)c1O
InChIInChI=1S/C14H17N3O2/c1-10-4-3-5-12(13(10)18)14(19)15-8-6-11-7-9-16-17(11)2/h3-5,7,9,18H,6,8H2,1-2H3,(H,15,19)
InChIKeyLZGFYVJYBQADLQ-UHFFFAOYSA-N
XLogP1.41
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dihydroxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 107723981
4-(ethylamino)-2-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 103011268
3-amino-4-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 103004037
2-hydroxy-5-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 104693736
1-methyl-3-[2-(2-methylpyrazol-3-yl)ethyl]urea
CID 104693382
5-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]furan-2-carboxamide
CID 104693705
3,5-dimethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]-1H-pyrazole-4-carboxamide
CID 113442300
3,4,5-trifluoro-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 104693722
5-bromo-N-[2-(2-methylpyrazol-3-yl)ethyl]thiophene-3-carboxamide
CID 104693664
5-amino-2-methoxy-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide
CID 103004068
2-fluoro-6-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]aniline
CID 103002231
4-amino-1-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazole-3-carboxamide
CID 103004054

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
The IUPAC name of 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide (CID 104693761) is 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide.
What is the SMILES notation for 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
The canonical SMILES for 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide is Cc1cccc(C(=O)NCCc2ccnn2C)c1O.
What is the InChIKey of 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
The InChIKey is LZGFYVJYBQADLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10-4-3-5-12(13(10)18)14(19)15-8-6-11-7-9-16-17(11)2/h3-5,7,9,18H,6,8H2,1-2H3,(H,15,19).
What are the key properties of 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide?
2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide has a molecular weight of 259.31 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]benzamide is sourced from PubChem (CID 104693761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).