3-(4-hydroxyphenyl)propanehydrazide

C9H12N2O2 — CID 2796587

IUPAC3-(4-hydroxyphenyl)propanehydrazide
SMILESNNC(=O)CCc1ccc(O)cc1
InChIInChI=1S/C9H12N2O2/c10-11-9(13)6-3-7-1-4-8(12)5-2-7/h1-2,4-5,12H,3,6,10H2,(H,11,13)
InChIKeyJMNHUOPRGLTNJI-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.31
Rot. Bonds3

About 3-(4-hydroxyphenyl)propanehydrazide

3-(4-hydroxyphenyl)propanehydrazide (PubChem CID 2796587) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 3-(4-hydroxyphenyl)propanehydrazide.

Molecular Properties

Compound Name3-(4-hydroxyphenyl)propanehydrazide
PubChem CID2796587
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name3-(4-hydroxyphenyl)propanehydrazide
SMILESNNC(=O)CCc1ccc(O)cc1
InChIInChI=1S/C9H12N2O2/c10-11-9(13)6-3-7-1-4-8(12)5-2-7/h1-2,4-5,12H,3,6,10H2,(H,11,13)
InChIKeyJMNHUOPRGLTNJI-UHFFFAOYSA-N
XLogP0.31
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxyphenyl)propanehydrazide?
The IUPAC name of 3-(4-hydroxyphenyl)propanehydrazide (CID 2796587) is 3-(4-hydroxyphenyl)propanehydrazide.
What is the SMILES notation for 3-(4-hydroxyphenyl)propanehydrazide?
The canonical SMILES for 3-(4-hydroxyphenyl)propanehydrazide is NNC(=O)CCc1ccc(O)cc1.
What is the InChIKey of 3-(4-hydroxyphenyl)propanehydrazide?
The InChIKey is JMNHUOPRGLTNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c10-11-9(13)6-3-7-1-4-8(12)5-2-7/h1-2,4-5,12H,3,6,10H2,(H,11,13).
What are the key properties of 3-(4-hydroxyphenyl)propanehydrazide?
3-(4-hydroxyphenyl)propanehydrazide has a molecular weight of 180.21 g/mol, XLogP of 0.31, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxyphenyl)propanehydrazide is sourced from PubChem (CID 2796587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).