3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide

C15H18N4O2 — CID 135517054

IUPAC3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide
SMILESCc1cc(C)n(CCC(=O)N/N=C/c2ccccc2O)n1
InChIInChI=1S/C15H18N4O2/c1-11-9-12(2)19(18-11)8-7-15(21)17-16-10-13-5-3-4-6-14(13)20/h3-6,9-10,20H,7-8H2,1-2H3,(H,17,21)/b16-10+
InChIKeyFIOPZCORJSNENW-MHWRWJLKSA-N
MW286.33 g/mol
LogP1.75
Rot. Bonds5

About 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide

3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide (PubChem CID 135517054) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide.

Molecular Properties

Compound Name3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide
PubChem CID135517054
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide
SMILESCc1cc(C)n(CCC(=O)N/N=C/c2ccccc2O)n1
InChIInChI=1S/C15H18N4O2/c1-11-9-12(2)19(18-11)8-7-15(21)17-16-10-13-5-3-4-6-14(13)20/h3-6,9-10,20H,7-8H2,1-2H3,(H,17,21)/b16-10+
InChIKeyFIOPZCORJSNENW-MHWRWJLKSA-N
XLogP1.75
TPSA79.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide 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-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(4-methoxyphenyl)methylideneamino]propanamide
CID 6882781
N-[(E)-(1-benzyl-3,5-dimethylpyrazol-4-yl)methylideneamino]-2-hydroxybenzamide
CID 6890491
N'-[(E)-(2-hydroxyphenyl)methylidene]-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetohydrazide
CID 135549910
2-(3,5-Dimethyl-1H-pyrazol-1-YL)-N'-[(E)-(2-hydroxy-5-nitrophenyl)methylidene]acetohydrazide
CID 135521475
N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propanehydrazide
CID 135517055
2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N'-[(1E)-1-(2-hydroxyphenyl)ethylidene]propanehydrazide
CID 135517113
(e)-3-(3,5-Dimethyl-1h-pyrazol-1-yl)-n'-((2-hydroxynaphthalen-1-yl)methylene)propanehydrazide
CID 135541142
(e)-3-(3,5-Dimethyl-1h-pyrazol-1-yl)-n'-(3-hydroxy-4-methoxybenzylidene)propanehydrazide
CID 6882870
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]propanehydrazide
CID 135650437
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N'-[(E)-(4-hydroxyphenyl)methylidene]propanehydrazide
CID 135517079
3-(1H-1,2,3-Benzotriazol-1-YL)N'-(1-(2-hydroxyphenyl)ethylidene)propanohydrazide
CID 135641993
2-(1-Methyl-1H-Pyrazol-5-Yl)Phenol
CID 2804778

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide?
The IUPAC name of 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide (CID 135517054) is 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide.
What is the SMILES notation for 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide?
The canonical SMILES for 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide is Cc1cc(C)n(CCC(=O)N/N=C/c2ccccc2O)n1.
What is the InChIKey of 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide?
The InChIKey is FIOPZCORJSNENW-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-11-9-12(2)19(18-11)8-7-15(21)17-16-10-13-5-3-4-6-14(13)20/h3-6,9-10,20H,7-8H2,1-2H3,(H,17,21)/b16-10+.
What are the key properties of 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide?
3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide has a molecular weight of 286.33 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethylpyrazol-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide is sourced from PubChem (CID 135517054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).