2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide

C17H18N2O3 — CID 31950720

IUPAC2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide
SMILESCc1ccc(CCC(=O)NNC(=O)c2ccccc2O)cc1
InChIInChI=1S/C17H18N2O3/c1-12-6-8-13(9-7-12)10-11-16(21)18-19-17(22)14-4-2-3-5-15(14)20/h2-9,20H,10-11H2,1H3,(H,18,21)(H,19,22)
InChIKeyBYUHDVHDEQVNTL-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.09
Rot. Bonds4

About 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide

2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide (PubChem CID 31950720) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide.

Molecular Properties

Compound Name2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide
PubChem CID31950720
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide
SMILESCc1ccc(CCC(=O)NNC(=O)c2ccccc2O)cc1
InChIInChI=1S/C17H18N2O3/c1-12-6-8-13(9-7-12)10-11-16(21)18-19-17(22)14-4-2-3-5-15(14)20/h2-9,20H,10-11H2,1H3,(H,18,21)(H,19,22)
InChIKeyBYUHDVHDEQVNTL-UHFFFAOYSA-N
XLogP2.09
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-N',3-N'-bis(2-hydroxybenzoyl)propanedihydrazide
CID 21348404
N'-[3-(4-methylphenyl)propanoyl]-1H-pyrrole-2-carbohydrazide
CID 78829860
2-bromo-N'-[3-(4-ethylphenyl)propanoyl]benzohydrazide
CID 9399855
N'-[2-(3,4-dimethylphenyl)acetyl]-2-hydroxybenzohydrazide
CID 7535148
N'-[3-(4-methoxyphenyl)propanoyl]-4-methylbenzohydrazide
CID 2672366
1-N',4-N'-bis(2-methylbenzoyl)butanedihydrazide
CID 4630875
5-bromo-N'-[3-(4-methylphenyl)propanoyl]thiophene-2-carbohydrazide
CID 31950441
3-(4-methylphenyl)-N-phenylpropanamide
CID 2995602
2-iodo-N-[2-[3-(4-methylphenyl)propanoylamino]ethyl]benzamide
CID 108539180
5-ethyl-2-hydroxy-N'-(2-hydroxybenzoyl)benzohydrazide
CID 60611924
2,5-dimethyl-1-phenyl-N'-(3-phenylpropanoyl)pyrrole-3-carbohydrazide
CID 40714000
N'-[3-(3,5-dimethylpyrazol-1-yl)propanoyl]-2-hydroxybenzohydrazide
CID 30124446

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide?
The IUPAC name of 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide (CID 31950720) is 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide.
What is the SMILES notation for 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide?
The canonical SMILES for 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide is Cc1ccc(CCC(=O)NNC(=O)c2ccccc2O)cc1.
What is the InChIKey of 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide?
The InChIKey is BYUHDVHDEQVNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-6-8-13(9-7-12)10-11-16(21)18-19-17(22)14-4-2-3-5-15(14)20/h2-9,20H,10-11H2,1H3,(H,18,21)(H,19,22).
What are the key properties of 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide?
2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide has a molecular weight of 298.34 g/mol, XLogP of 2.09, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N'-[3-(4-methylphenyl)propanoyl]benzohydrazide is sourced from PubChem (CID 31950720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).