4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide

C13H15N3O2 — CID 113343584

IUPAC4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
SMILESCc1cc(O)ccc1C(=O)NCc1ccn(C)n1
InChIInChI=1S/C13H15N3O2/c1-9-7-11(17)3-4-12(9)13(18)14-8-10-5-6-16(2)15-10/h3-7,17H,8H2,1-2H3,(H,14,18)
InChIKeyFJEBHOOWRHXVMX-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.36
Rot. Bonds3

About 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide

4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide (PubChem CID 113343584) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
PubChem CID113343584
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
SMILESCc1cc(O)ccc1C(=O)NCc1ccn(C)n1
InChIInChI=1S/C13H15N3O2/c1-9-7-11(17)3-4-12(9)13(18)14-8-10-5-6-16(2)15-10/h3-7,17H,8H2,1-2H3,(H,14,18)
InChIKeyFJEBHOOWRHXVMX-UHFFFAOYSA-N
XLogP1.36
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 19330914
2-bromo-4-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 82872826
5-amino-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 82882259
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-4-hydroxy-2-methylbenzamide
CID 103899206
4-hydroxy-N-[(4-hydroxyphenyl)methyl]-2-methylbenzamide
CID 103867255
2-hydroxy-5-iodo-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 103877808
2-fluoro-5-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide
CID 82882306
2-methyl-4-(methylamino)-N-[2-(1-methylpyrazol-3-yl)ethyl]benzamide
CID 106106392
N-[[4-(aminomethyl)phenyl]methyl]-4-hydroxy-2-methylbenzamide
CID 107670516
N-[(1-methylpyrazol-3-yl)methyl]-2-(2,4,6-trimethylphenyl)acetamide
CID 122159302
5-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1H-pyrazole-4-carboxamide
CID 82873476
4-hydroxy-2-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 113341365

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide?
The IUPAC name of 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide (CID 113343584) is 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide.
What is the SMILES notation for 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide?
The canonical SMILES for 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide is Cc1cc(O)ccc1C(=O)NCc1ccn(C)n1.
What is the InChIKey of 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide?
The InChIKey is FJEBHOOWRHXVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9-7-11(17)3-4-12(9)13(18)14-8-10-5-6-16(2)15-10/h3-7,17H,8H2,1-2H3,(H,14,18).
What are the key properties of 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide?
4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide has a molecular weight of 245.28 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]benzamide is sourced from PubChem (CID 113343584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).