[1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine

C17H21ClN2O — CID 105287885

IUPAC[1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine
SMILESCCc1ccc(CC(COc2ccc(Cl)cc2)NN)cc1
InChIInChI=1S/C17H21ClN2O/c1-2-13-3-5-14(6-4-13)11-16(20-19)12-21-17-9-7-15(18)8-10-17/h3-10,16,20H,2,11-12,19H2,1H3
InChIKeyDUAOSZRBTJCLKS-UHFFFAOYSA-N
MW304.82 g/mol
LogP3.36
Rot. Bonds7

About [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine

[1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine (PubChem CID 105287885) has the molecular formula C17H21ClN2O and a molecular weight of 304.82 g/mol. Its IUPAC name is [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine
PubChem CID105287885
Molecular FormulaC17H21ClN2O
Molecular Weight304.82 g/mol
Exact Mass304.13
IUPAC Name[1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine
SMILESCCc1ccc(CC(COc2ccc(Cl)cc2)NN)cc1
InChIInChI=1S/C17H21ClN2O/c1-2-13-3-5-14(6-4-13)11-16(20-19)12-21-17-9-7-15(18)8-10-17/h3-10,16,20H,2,11-12,19H2,1H3
InChIKeyDUAOSZRBTJCLKS-UHFFFAOYSA-N
XLogP3.36
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.82
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[1-(4-chlorophenoxy)-3-(3,4-difluorophenyl)propan-2-yl]hydrazine
CID 105330358
1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-amine
CID 105101373
1-(4-chlorophenoxy)-N-methyl-3-phenylpropan-2-amine
CID 105084979
[1-(4-chlorophenoxy)-3-(2,5-dichlorophenyl)propan-2-yl]hydrazine
CID 105309838
[1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine
CID 105296649
1-(4-chlorophenoxy)hept-5-yn-2-ylhydrazine
CID 105334964
1-(4-ethylphenoxy)-N-methylbutan-2-amine
CID 62038493
[1-(4-chlorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105283291
[1-(4-chlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 105206174
[1-(3-chlorophenoxy)-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 105284980
4-(4-chlorophenyl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259401
1-(4-chlorophenoxy)-N-methylhexan-2-amine
CID 105125626

Frequently Asked Questions

What is the IUPAC name of [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine (CID 105287885) is [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine is CCc1ccc(CC(COc2ccc(Cl)cc2)NN)cc1.
What is the InChIKey of [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine?
The InChIKey is DUAOSZRBTJCLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClN2O/c1-2-13-3-5-14(6-4-13)11-16(20-19)12-21-17-9-7-15(18)8-10-17/h3-10,16,20H,2,11-12,19H2,1H3.
What are the key properties of [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine?
[1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine has a molecular weight of 304.82 g/mol, XLogP of 3.36, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105287885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).