[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine

C15H18ClN3O — CID 105194775

IUPAC[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2cccc(Cl)c2)c1
InChIInChI=1S/C15H18ClN3O/c1-2-6-20-14-8-12(9-18-10-14)15(19-17)11-4-3-5-13(16)7-11/h3-5,7-10,15,19H,2,6,17H2,1H3
InChIKeySJSMCERRYINDPL-UHFFFAOYSA-N
MW291.78 g/mol
LogP3.08
Rot. Bonds6

About [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine

[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 105194775) has the molecular formula C15H18ClN3O and a molecular weight of 291.78 g/mol. Its IUPAC name is [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
PubChem CID105194775
Molecular FormulaC15H18ClN3O
Molecular Weight291.78 g/mol
Exact Mass291.11
IUPAC Name[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2cccc(Cl)c2)c1
InChIInChI=1S/C15H18ClN3O/c1-2-6-20-14-8-12(9-18-10-14)15(19-17)11-4-3-5-13(16)7-11/h3-5,7-10,15,19H,2,6,17H2,1H3
InChIKeySJSMCERRYINDPL-UHFFFAOYSA-N
XLogP3.08
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.78
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[(3-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105193158
[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105217975
[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 107948448
[(3-bromo-4-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105264229
1-(3,5-dichlorophenyl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 105026931
[(3,5-dichlorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105329954
[(5-propoxy-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine
CID 105193764
[(3-chlorophenyl)-(2-propoxyphenyl)methyl]hydrazine
CID 105194583
[(2-methylsulfanylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330102
1-(3-chlorophenyl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 62795601
[(2-fluoro-4-methylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330079
1-(5-methoxy-3-pyridinyl)-N-methyl-1-(3-propoxyphenyl)methanamine
CID 105025977

Frequently Asked Questions

What is the IUPAC name of [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (CID 105194775) is [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is CCCOc1cncc(C(NN)c2cccc(Cl)c2)c1.
What is the InChIKey of [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is SJSMCERRYINDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3O/c1-2-6-20-14-8-12(9-18-10-14)15(19-17)11-4-3-5-13(16)7-11/h3-5,7-10,15,19H,2,6,17H2,1H3.
What are the key properties of [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 291.78 g/mol, XLogP of 3.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105194775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).