2-(2-chloro-4-ethylphenoxy)propanehydrazide

C11H15ClN2O2 — CID 54793011

IUPAC2-(2-chloro-4-ethylphenoxy)propanehydrazide
SMILESCCc1ccc(OC(C)C(=O)NN)c(Cl)c1
InChIInChI=1S/C11H15ClN2O2/c1-3-8-4-5-10(9(12)6-8)16-7(2)11(15)14-13/h4-7H,3,13H2,1-2H3,(H,14,15)
InChIKeyUELVDKZTZUJSAO-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.66
Rot. Bonds4

About 2-(2-chloro-4-ethylphenoxy)propanehydrazide

2-(2-chloro-4-ethylphenoxy)propanehydrazide (PubChem CID 54793011) has the molecular formula C11H15ClN2O2 and a molecular weight of 242.71 g/mol. Its IUPAC name is 2-(2-chloro-4-ethylphenoxy)propanehydrazide.

Molecular Properties

Compound Name2-(2-chloro-4-ethylphenoxy)propanehydrazide
PubChem CID54793011
Molecular FormulaC11H15ClN2O2
Molecular Weight242.71 g/mol
Exact Mass242.08
IUPAC Name2-(2-chloro-4-ethylphenoxy)propanehydrazide
SMILESCCc1ccc(OC(C)C(=O)NN)c(Cl)c1
InChIInChI=1S/C11H15ClN2O2/c1-3-8-4-5-10(9(12)6-8)16-7(2)11(15)14-13/h4-7H,3,13H2,1-2H3,(H,14,15)
InChIKeyUELVDKZTZUJSAO-UHFFFAOYSA-N
XLogP1.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.66
H-Bond Donors ≤ 52
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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Related Compounds

2-[4-(aminomethyl)-2-chlorophenoxy]-N-methylpropanamide
CID 61389158
2-[4-(aminomethyl)-2-chlorophenoxy]-N-propan-2-ylpropanamide
CID 54984073
2-[4-(aminomethyl)-2-chlorophenoxy]-N-pentylpropanamide
CID 61389141
2-(4-bromo-2,5-dichlorophenoxy)propanehydrazide
CID 107661601
(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide
CID 874427
(2R)-2-(2,4-dichlorophenoxy)-N-ethoxypropanamide
CID 30690113
[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] (2R)-2-(2,4-dichlorophenoxy)propanoate
CID 7872819
2-[3-chloro-4-(1-ethoxy-1-oxopropan-2-yl)oxyphenyl]acetic acid
CID 110190887
2-[2-chloro-4-[(2-methylpropylamino)methyl]phenoxy]-N-methylpropanamide
CID 63058381
2-(2-chloro-4-ethylphenoxy)pentanoic acid
CID 54793091
2-[4-[(1S)-1-aminoethyl]-2-chlorophenoxy]-N-ethylpropanamide
CID 113389817
(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide
CID 785428

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-ethylphenoxy)propanehydrazide?
The IUPAC name of 2-(2-chloro-4-ethylphenoxy)propanehydrazide (CID 54793011) is 2-(2-chloro-4-ethylphenoxy)propanehydrazide.
What is the SMILES notation for 2-(2-chloro-4-ethylphenoxy)propanehydrazide?
The canonical SMILES for 2-(2-chloro-4-ethylphenoxy)propanehydrazide is CCc1ccc(OC(C)C(=O)NN)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-ethylphenoxy)propanehydrazide?
The InChIKey is UELVDKZTZUJSAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2/c1-3-8-4-5-10(9(12)6-8)16-7(2)11(15)14-13/h4-7H,3,13H2,1-2H3,(H,14,15).
What are the key properties of 2-(2-chloro-4-ethylphenoxy)propanehydrazide?
2-(2-chloro-4-ethylphenoxy)propanehydrazide has a molecular weight of 242.71 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-ethylphenoxy)propanehydrazide is sourced from PubChem (CID 54793011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).