2-(2-prop-2-enoxyethoxy)benzohydrazide

C12H16N2O3 — CID 63576125

IUPAC2-(2-prop-2-enoxyethoxy)benzohydrazide
SMILESC=CCOCCOc1ccccc1C(=O)NN
InChIInChI=1S/C12H16N2O3/c1-2-7-16-8-9-17-11-6-4-3-5-10(11)12(15)14-13/h2-6H,1,7-9,13H2,(H,14,15)
InChIKeyBOLLNULSDPNKPQ-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.87
Rot. Bonds7

About 2-(2-prop-2-enoxyethoxy)benzohydrazide

2-(2-prop-2-enoxyethoxy)benzohydrazide (PubChem CID 63576125) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-(2-prop-2-enoxyethoxy)benzohydrazide.

Molecular Properties

Compound Name2-(2-prop-2-enoxyethoxy)benzohydrazide
PubChem CID63576125
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name2-(2-prop-2-enoxyethoxy)benzohydrazide
SMILESC=CCOCCOc1ccccc1C(=O)NN
InChIInChI=1S/C12H16N2O3/c1-2-7-16-8-9-17-11-6-4-3-5-10(11)12(15)14-13/h2-6H,1,7-9,13H2,(H,14,15)
InChIKeyBOLLNULSDPNKPQ-UHFFFAOYSA-N
XLogP0.87
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-iodophenoxy)ethoxy]benzohydrazide
CID 63570332
2-[2-(4-methylpentan-2-yloxy)ethoxy]benzohydrazide
CID 63574572
2-pentoxybenzohydrazide
CID 54793215
2-[2-[2-(2-carboxyphenoxy)ethoxy]ethoxy]benzoic acid
CID 2215647
N-[2-(2-prop-2-enoxyethoxy)phenyl]acetamide
CID 86096394
2-(2-ethoxyethoxy)-N'-(4-prop-2-enoxybenzoyl)benzohydrazide
CID 17122908
2-(2-prop-2-enoyloxyethoxy)benzoic acid
CID 18974630
2-[2-[2-(2-carbonochloridoylphenoxy)ethoxy]ethoxy]benzoyl chloride
CID 10981850
2-(2-cycloheptyloxyethoxy)benzohydrazide
CID 63570919
2-[2-(prop-2-enoxycarbonylamino)ethoxy]benzoic acid
CID 166000723
2-(2-phenoxyethoxy)-N-(2-prop-2-enoxyphenyl)benzamide
CID 17098022
N-methoxy-2-(2-methoxyethoxy)benzamide
CID 47366431

Frequently Asked Questions

What is the IUPAC name of 2-(2-prop-2-enoxyethoxy)benzohydrazide?
The IUPAC name of 2-(2-prop-2-enoxyethoxy)benzohydrazide (CID 63576125) is 2-(2-prop-2-enoxyethoxy)benzohydrazide.
What is the SMILES notation for 2-(2-prop-2-enoxyethoxy)benzohydrazide?
The canonical SMILES for 2-(2-prop-2-enoxyethoxy)benzohydrazide is C=CCOCCOc1ccccc1C(=O)NN.
What is the InChIKey of 2-(2-prop-2-enoxyethoxy)benzohydrazide?
The InChIKey is BOLLNULSDPNKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-2-7-16-8-9-17-11-6-4-3-5-10(11)12(15)14-13/h2-6H,1,7-9,13H2,(H,14,15).
What are the key properties of 2-(2-prop-2-enoxyethoxy)benzohydrazide?
2-(2-prop-2-enoxyethoxy)benzohydrazide has a molecular weight of 236.27 g/mol, XLogP of 0.87, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-prop-2-enoxyethoxy)benzohydrazide is sourced from PubChem (CID 63576125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).