N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide

C15H20N2O4 — CID 2861983

IUPACN'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide
SMILESCc1cc(C)cc(OCC(=O)NNC(=O)C2CCCO2)c1
InChIInChI=1S/C15H20N2O4/c1-10-6-11(2)8-12(7-10)21-9-14(18)16-17-15(19)13-4-3-5-20-13/h6-8,13H,3-5,9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyUGANQWZDGQKBRI-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.01
Rot. Bonds4

About N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide

N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide (PubChem CID 2861983) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide
PubChem CID2861983
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC NameN'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide
SMILESCc1cc(C)cc(OCC(=O)NNC(=O)C2CCCO2)c1
InChIInChI=1S/C15H20N2O4/c1-10-6-11(2)8-12(7-10)21-9-14(18)16-17-15(19)13-4-3-5-20-13/h6-8,13H,3-5,9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyUGANQWZDGQKBRI-UHFFFAOYSA-N
XLogP1.01
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide?
The IUPAC name of N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide (CID 2861983) is N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide.
What is the SMILES notation for N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide?
The canonical SMILES for N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide is Cc1cc(C)cc(OCC(=O)NNC(=O)C2CCCO2)c1.
What is the InChIKey of N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide?
The InChIKey is UGANQWZDGQKBRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-10-6-11(2)8-12(7-10)21-9-14(18)16-17-15(19)13-4-3-5-20-13/h6-8,13H,3-5,9H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide?
N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide has a molecular weight of 292.33 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3,5-dimethylphenoxy)acetyl]oxolane-2-carbohydrazide is sourced from PubChem (CID 2861983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).