N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide

C15H20N2O3 — CID 17169360

IUPACN'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide
SMILESCc1ccc(OC(C)C(=O)NNC(=O)C2CC2)cc1C
InChIInChI=1S/C15H20N2O3/c1-9-4-7-13(8-10(9)2)20-11(3)14(18)16-17-15(19)12-5-6-12/h4,7-8,11-12H,5-6H2,1-3H3,(H,16,18)(H,17,19)
InChIKeyNSJAWFBUQIAQGH-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.63
Rot. Bonds4

About N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide

N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide (PubChem CID 17169360) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide.

Molecular Properties

Compound NameN'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide
PubChem CID17169360
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide
SMILESCc1ccc(OC(C)C(=O)NNC(=O)C2CC2)cc1C
InChIInChI=1S/C15H20N2O3/c1-9-4-7-13(8-10(9)2)20-11(3)14(18)16-17-15(19)12-5-6-12/h4,7-8,11-12H,5-6H2,1-3H3,(H,16,18)(H,17,19)
InChIKeyNSJAWFBUQIAQGH-UHFFFAOYSA-N
XLogP1.63
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide 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

1-N',4-N'-bis[2-(3,4-dimethylphenoxy)propanoyl]cyclohexane-1,4-dicarbohydrazide
CID 17169729
N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]cyclopropanecarboxamide
CID 17169509
N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide
CID 51165989
N'-(2-naphthalen-2-yloxypropanoyl)cyclopropanecarbohydrazide
CID 4940181
N'-[2-(3,4-dimethylphenoxy)propanoyl]-2-phenoxypropanehydrazide
CID 17169390
N'-[2-(3,4-dimethylphenoxy)propanoyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 17169425
N'-[2-(2,5-dimethylphenoxy)propanoyl]cyclohexanecarbohydrazide
CID 4945045
N'-[(2S)-2-(4-ethoxyphenoxy)propanoyl]cyclobutanecarbohydrazide
CID 9343434
N'-[(2R)-2-(4-ethoxyphenoxy)propanoyl]cyclobutanecarbohydrazide
CID 9343438
3,5-dichloro-N'-[2-(3,4-dimethylphenoxy)propanoyl]benzohydrazide
CID 17169474
N'-[2-(2,4-ditert-butylphenoxy)acetyl]-2-(3,4-dimethylphenoxy)propanehydrazide
CID 17169454
N-[2-[2-(3-methyl-4-propan-2-ylphenoxy)propanoylamino]ethyl]cyclohexanecarboxamide
CID 55805598

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide?
The IUPAC name of N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide (CID 17169360) is N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide.
What is the SMILES notation for N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide?
The canonical SMILES for N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide is Cc1ccc(OC(C)C(=O)NNC(=O)C2CC2)cc1C.
What is the InChIKey of N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide?
The InChIKey is NSJAWFBUQIAQGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-9-4-7-13(8-10(9)2)20-11(3)14(18)16-17-15(19)12-5-6-12/h4,7-8,11-12H,5-6H2,1-3H3,(H,16,18)(H,17,19).
What are the key properties of N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide?
N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide has a molecular weight of 276.34 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide is sourced from PubChem (CID 17169360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).