[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine

C15H17ClFN3O — CID 105217975

IUPAC[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2ccc(Cl)cc2F)c1
InChIInChI=1S/C15H17ClFN3O/c1-2-5-21-12-6-10(8-19-9-12)15(20-18)13-4-3-11(16)7-14(13)17/h3-4,6-9,15,20H,2,5,18H2,1H3
InChIKeyDHSVNBNGBCZYCD-UHFFFAOYSA-N
MW309.77 g/mol
LogP3.22
Rot. Bonds6

About [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine

[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 105217975) has the molecular formula C15H17ClFN3O and a molecular weight of 309.77 g/mol. Its IUPAC name is [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
PubChem CID105217975
Molecular FormulaC15H17ClFN3O
Molecular Weight309.77 g/mol
Exact Mass309.10
IUPAC Name[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
SMILESCCCOc1cncc(C(NN)c2ccc(Cl)cc2F)c1
InChIInChI=1S/C15H17ClFN3O/c1-2-5-21-12-6-10(8-19-9-12)15(20-18)13-4-3-11(16)7-14(13)17/h3-4,6-9,15,20H,2,5,18H2,1H3
InChIKeyDHSVNBNGBCZYCD-UHFFFAOYSA-N
XLogP3.22
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.77
LogP ≤ 53.22
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

[(2-fluoro-4-methylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330079
[(3-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105194775
[(3-bromo-4-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105264229
[(4-chloro-2-methoxyphenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105330019
[(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105329963
[(2-methylsulfanylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330102
[(3-bromo-5-chlorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 107948448
[(3-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105193158
[(2,5-dimethylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330089
[(3-methoxy-4-pyridinyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330149
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

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine (CID 105217975) is [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is CCCOc1cncc(C(NN)c2ccc(Cl)cc2F)c1.
What is the InChIKey of [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is DHSVNBNGBCZYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClFN3O/c1-2-5-21-12-6-10(8-19-9-12)15(20-18)13-4-3-11(16)7-14(13)17/h3-4,6-9,15,20H,2,5,18H2,1H3.
What are the key properties of [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine?
[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 309.77 g/mol, XLogP of 3.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105217975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).