[2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine

C13H14ClN3O — CID 79260404

IUPAC[2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine
SMILESCc1ccc(Cl)cc1OCc1cc(NN)ccn1
InChIInChI=1S/C13H14ClN3O/c1-9-2-3-10(14)6-13(9)18-8-12-7-11(17-15)4-5-16-12/h2-7H,8,15H2,1H3,(H,16,17)
InChIKeyVBRKIPNBJAKNLW-UHFFFAOYSA-N
MW263.73 g/mol
LogP2.91
Rot. Bonds4

About [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine

[2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine (PubChem CID 79260404) has the molecular formula C13H14ClN3O and a molecular weight of 263.73 g/mol. Its IUPAC name is [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine.

Molecular Properties

Compound Name[2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine
PubChem CID79260404
Molecular FormulaC13H14ClN3O
Molecular Weight263.73 g/mol
Exact Mass263.08
IUPAC Name[2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine
SMILESCc1ccc(Cl)cc1OCc1cc(NN)ccn1
InChIInChI=1S/C13H14ClN3O/c1-9-2-3-10(14)6-13(9)18-8-12-7-11(17-15)4-5-16-12/h2-7H,8,15H2,1H3,(H,16,17)
InChIKeyVBRKIPNBJAKNLW-UHFFFAOYSA-N
XLogP2.91
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.73
LogP ≤ 52.91
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-[(2-chloro-5-methylphenoxy)methyl]-4-pyridinyl]hydrazine
CID 79259210
[2-[(2,4-dimethylphenoxy)methyl]-4-pyridinyl]hydrazine
CID 79260395
[2-[(3,4-dimethylphenoxy)methyl]-4-pyridinyl]hydrazine
CID 79260213
[2-[(2,5-difluorophenoxy)methyl]-4-pyridinyl]hydrazine
CID 79260041
[2-[(2-bromo-4-chloro-5-fluorophenoxy)methyl]-4-pyridinyl]hydrazine
CID 114042777
[2-[(2-tert-butyl-4-methylphenoxy)methyl]-4-pyridinyl]hydrazine
CID 79262186
5-[(5-chloro-2-methylphenoxy)methyl]pyrazin-2-amine
CID 103059224
2-[(2,5-dimethylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79250898
2-chloro-6-[(5-chloro-2-methylphenoxy)methyl]pyridine
CID 79243153
[2-[(2,3,5,6-tetrafluorophenoxy)methyl]-4-pyridinyl]hydrazine
CID 103290223
2-[(5-chloro-2-methylphenoxy)methyl]-4-methoxy-6-methylpyridine
CID 82895251
[2-(propoxymethyl)-4-pyridinyl]hydrazine
CID 79259211

Frequently Asked Questions

What is the IUPAC name of [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine?
The IUPAC name of [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine (CID 79260404) is [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine.
What is the SMILES notation for [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine?
The canonical SMILES for [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine is Cc1ccc(Cl)cc1OCc1cc(NN)ccn1.
What is the InChIKey of [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine?
The InChIKey is VBRKIPNBJAKNLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O/c1-9-2-3-10(14)6-13(9)18-8-12-7-11(17-15)4-5-16-12/h2-7H,8,15H2,1H3,(H,16,17).
What are the key properties of [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine?
[2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine has a molecular weight of 263.73 g/mol, XLogP of 2.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-chloro-2-methylphenoxy)methyl]-4-pyridinyl]hydrazine is sourced from PubChem (CID 79260404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).