[6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine

C17H23N3O — CID 79232587

IUPAC[6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine
SMILESCc1cc(C(C)(C)C)ccc1OCc1cccc(NN)n1
InChIInChI=1S/C17H23N3O/c1-12-10-13(17(2,3)4)8-9-15(12)21-11-14-6-5-7-16(19-14)20-18/h5-10H,11,18H2,1-4H3,(H,19,20)
InChIKeyYFGFIEQWCGJSBI-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.55
Rot. Bonds4

About [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine

[6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine (PubChem CID 79232587) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine
PubChem CID79232587
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name[6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine
SMILESCc1cc(C(C)(C)C)ccc1OCc1cccc(NN)n1
InChIInChI=1S/C17H23N3O/c1-12-10-13(17(2,3)4)8-9-15(12)21-11-14-6-5-7-16(19-14)20-18/h5-10H,11,18H2,1-4H3,(H,19,20)
InChIKeyYFGFIEQWCGJSBI-UHFFFAOYSA-N
XLogP3.55
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.55
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

[6-[(3-tert-butylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 79230468
[6-[(4-chloro-3,5-dimethylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 79232634
[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 79233690
[6-[(4-bromo-3-methylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 83140991
[4-[(6-hydrazinyl-2-pyridinyl)methoxy]-3-methoxyphenyl]methanol
CID 107744846
[6-[(2-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 79231281
[6-[(4-methoxy-2-nitrophenoxy)methyl]-2-pyridinyl]hydrazine
CID 79233113
2-[(4-tert-butyl-2-methylphenoxy)methyl]-N-methylpyridin-4-amine
CID 79244187
[6-[(2,3,4,5,6-pentafluorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 79231511
[6-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 103290222
2-[2-[(6-hydrazinyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 107714111
[6-[(2,4-dimethyl-6-nitrophenoxy)methyl]-2-pyridinyl]hydrazine
CID 79231223

Frequently Asked Questions

What is the IUPAC name of [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine?
The IUPAC name of [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine (CID 79232587) is [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine is Cc1cc(C(C)(C)C)ccc1OCc1cccc(NN)n1.
What is the InChIKey of [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine?
The InChIKey is YFGFIEQWCGJSBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-12-10-13(17(2,3)4)8-9-15(12)21-11-14-6-5-7-16(19-14)20-18/h5-10H,11,18H2,1-4H3,(H,19,20).
What are the key properties of [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine?
[6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine has a molecular weight of 285.39 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(4-tert-butyl-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 79232587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).