[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine

C17H23N3O — CID 105330458

IUPAC[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2cncc(OC(C)C)c2)c1C
InChIInChI=1S/C17H23N3O/c1-11(2)21-15-8-14(9-19-10-15)17(20-18)16-7-5-6-12(3)13(16)4/h5-11,17,20H,18H2,1-4H3
InChIKeyZOLDMVCHRKNLII-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.04
Rot. Bonds5

About [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine

[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine (PubChem CID 105330458) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
PubChem CID105330458
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2cncc(OC(C)C)c2)c1C
InChIInChI=1S/C17H23N3O/c1-11(2)21-15-8-14(9-19-10-15)17(20-18)16-7-5-6-12(3)13(16)4/h5-11,17,20H,18H2,1-4H3
InChIKeyZOLDMVCHRKNLII-UHFFFAOYSA-N
XLogP3.04
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.04
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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Frequently Asked Questions

What is the IUPAC name of [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine (CID 105330458) is [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine is Cc1cccc(C(NN)c2cncc(OC(C)C)c2)c1C.
What is the InChIKey of [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
The InChIKey is ZOLDMVCHRKNLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-11(2)21-15-8-14(9-19-10-15)17(20-18)16-7-5-6-12(3)13(16)4/h5-11,17,20H,18H2,1-4H3.
What are the key properties of [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine?
[(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine has a molecular weight of 285.39 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,3-dimethylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105330458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).