[2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine

C15H21ClN4O — CID 105306951

IUPAC[2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine
SMILESCCCn1nccc1C(NN)C(C)Oc1cccc(Cl)c1
InChIInChI=1S/C15H21ClN4O/c1-3-9-20-14(7-8-18-20)15(19-17)11(2)21-13-6-4-5-12(16)10-13/h4-8,10-11,15,19H,3,9,17H2,1-2H3
InChIKeyQVIJIKZGHMXRIM-UHFFFAOYSA-N
MW308.81 g/mol
LogP2.92
Rot. Bonds7

About [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine

[2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine (PubChem CID 105306951) has the molecular formula C15H21ClN4O and a molecular weight of 308.81 g/mol. Its IUPAC name is [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine.

Molecular Properties

Compound Name[2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine
PubChem CID105306951
Molecular FormulaC15H21ClN4O
Molecular Weight308.81 g/mol
Exact Mass308.14
IUPAC Name[2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine
SMILESCCCn1nccc1C(NN)C(C)Oc1cccc(Cl)c1
InChIInChI=1S/C15H21ClN4O/c1-3-9-20-14(7-8-18-20)15(19-17)11(2)21-13-6-4-5-12(16)10-13/h4-8,10-11,15,19H,3,9,17H2,1-2H3
InChIKeyQVIJIKZGHMXRIM-UHFFFAOYSA-N
XLogP2.92
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.81
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[2-(3-chlorophenoxy)-1-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 105288679
[2-(3-chlorophenoxy)-1-(2-ethylpyrazol-3-yl)ethyl]hydrazine
CID 105307108
[2-(3-chlorophenoxy)-1-(2,3-difluorophenyl)propyl]hydrazine
CID 105309301
[2-propyl-1-(2-propylpyrazol-3-yl)pentyl]hydrazine
CID 105306943
[1-(5-bromo-3-methyltriazol-4-yl)-2-(3-chlorophenoxy)propyl]hydrazine
CID 106466368
[(5-chloro-2-methoxyphenyl)-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105307007
[2-(3-chlorophenoxy)-1-(2-methoxyphenyl)propyl]hydrazine
CID 105285682
[1-(3-chloro-4-methylphenyl)-2-(3-chlorophenoxy)propyl]hydrazine
CID 107562651
[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine
CID 106649782
[3,3,3-trifluoro-1-(2-propylpyrazol-3-yl)-2-(trifluoromethyl)propyl]hydrazine
CID 103312805
[2-(3-chlorophenoxy)-1-thiophen-3-ylpropyl]hydrazine
CID 105311964
[2-(3-chlorophenoxy)-1-(2,4-difluorophenyl)propyl]hydrazine
CID 105303167

Frequently Asked Questions

What is the IUPAC name of [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine?
The IUPAC name of [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine (CID 105306951) is [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine.
What is the SMILES notation for [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine?
The canonical SMILES for [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine is CCCn1nccc1C(NN)C(C)Oc1cccc(Cl)c1.
What is the InChIKey of [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine?
The InChIKey is QVIJIKZGHMXRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN4O/c1-3-9-20-14(7-8-18-20)15(19-17)11(2)21-13-6-4-5-12(16)10-13/h4-8,10-11,15,19H,3,9,17H2,1-2H3.
What are the key properties of [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine?
[2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine has a molecular weight of 308.81 g/mol, XLogP of 2.92, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine is sourced from PubChem (CID 105306951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).