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

C15H17BrClN3O — CID 107948448

IUPAC[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2cc(Cl)cc(Br)c2)c1
InChIInChI=1S/C15H17BrClN3O/c1-2-3-21-14-6-11(8-19-9-14)15(20-18)10-4-12(16)7-13(17)5-10/h4-9,15,20H,2-3,18H2,1H3
InChIKeyRXELKXZWBSRHNT-UHFFFAOYSA-N
MW370.68 g/mol
LogP3.84
Rot. Bonds6

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

[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 107948448) has the molecular formula C15H17BrClN3O and a molecular weight of 370.68 g/mol. Its IUPAC name is [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
PubChem CID107948448
Molecular FormulaC15H17BrClN3O
Molecular Weight370.68 g/mol
Exact Mass369.02
IUPAC Name[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2cc(Cl)cc(Br)c2)c1
InChIInChI=1S/C15H17BrClN3O/c1-2-3-21-14-6-11(8-19-9-14)15(20-18)10-4-12(16)7-13(17)5-10/h4-9,15,20H,2-3,18H2,1H3
InChIKeyRXELKXZWBSRHNT-UHFFFAOYSA-N
XLogP3.84
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.68
LogP ≤ 53.84
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-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105194775
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
[(3-bromo-4-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105264229
[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105217975
[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 107948433
1-(3-bromo-5-chlorophenyl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 107945718
[(3-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105193158
(3-bromo-5-chlorophenyl)-(5-ethoxy-3-pyridinyl)methanol
CID 107947736
[(5-propoxy-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine
CID 105193764
[(4-methylthiadiazol-5-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330043
[(2-fluoro-4-methylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330079

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (CID 107948448) is [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is CCCOc1cncc(C(NN)c2cc(Cl)cc(Br)c2)c1.
What is the InChIKey of [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is RXELKXZWBSRHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrClN3O/c1-2-3-21-14-6-11(8-19-9-14)15(20-18)10-4-12(16)7-13(17)5-10/h4-9,15,20H,2-3,18H2,1H3.
What are the key properties of [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 370.68 g/mol, XLogP of 3.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 107948448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).