[(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine

C14H14ClF2N3O — CID 105329963

IUPAC[(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
SMILESCCOc1cncc(C(NN)c2cc(F)c(Cl)cc2F)c1
InChIInChI=1S/C14H14ClF2N3O/c1-2-21-9-3-8(6-19-7-9)14(20-18)10-4-13(17)11(15)5-12(10)16/h3-7,14,20H,2,18H2,1H3
InChIKeyNOWOZEVKBYGOMA-UHFFFAOYSA-N
MW313.74 g/mol
LogP2.96
Rot. Bonds5

About [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine

[(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 105329963) has the molecular formula C14H14ClF2N3O and a molecular weight of 313.74 g/mol. Its IUPAC name is [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
PubChem CID105329963
Molecular FormulaC14H14ClF2N3O
Molecular Weight313.74 g/mol
Exact Mass313.08
IUPAC Name[(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
SMILESCCOc1cncc(C(NN)c2cc(F)c(Cl)cc2F)c1
InChIInChI=1S/C14H14ClF2N3O/c1-2-21-9-3-8(6-19-7-9)14(20-18)10-4-13(17)11(15)5-12(10)16/h3-7,14,20H,2,18H2,1H3
InChIKeyNOWOZEVKBYGOMA-UHFFFAOYSA-N
XLogP2.96
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.74
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2,4-difluoro-5-methylphenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105329988
[(3,5-dichlorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105329954
[(2,3-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105329980
[(4-chloro-2-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105217975
[(4-chloro-2-methoxyphenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105330019
[(5-ethoxy-3-pyridinyl)-(5-fluoro-2-methylphenyl)methyl]hydrazine
CID 105211593
[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 103445839
[(2-fluoro-4-methylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330079
[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105288044
[(4-chloro-2,5-difluorophenyl)-(6-methyl-3-pyridinyl)methyl]hydrazine
CID 105305537
[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine
CID 105254414
[(3,5-dimethyl-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105266409

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine (CID 105329963) is [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine is CCOc1cncc(C(NN)c2cc(F)c(Cl)cc2F)c1.
What is the InChIKey of [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is NOWOZEVKBYGOMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClF2N3O/c1-2-21-9-3-8(6-19-7-9)14(20-18)10-4-13(17)11(15)5-12(10)16/h3-7,14,20H,2,18H2,1H3.
What are the key properties of [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine?
[(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 313.74 g/mol, XLogP of 2.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-2,5-difluorophenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105329963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).