[2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine

C12H15N3O — CID 62319749

IUPAC[2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine
SMILESCOCc1cc(NN)c2cccc(C)c2n1
InChIInChI=1S/C12H15N3O/c1-8-4-3-5-10-11(15-13)6-9(7-16-2)14-12(8)10/h3-6H,7,13H2,1-2H3,(H,14,15)
InChIKeySHNMYVXTNQJZHS-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.98
Rot. Bonds3

About [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine

[2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine (PubChem CID 62319749) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine
PubChem CID62319749
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name[2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine
SMILESCOCc1cc(NN)c2cccc(C)c2n1
InChIInChI=1S/C12H15N3O/c1-8-4-3-5-10-11(15-13)6-9(7-16-2)14-12(8)10/h3-6H,7,13H2,1-2H3,(H,14,15)
InChIKeySHNMYVXTNQJZHS-UHFFFAOYSA-N
XLogP1.98
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.98
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-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine?
The IUPAC name of [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine (CID 62319749) is [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine.
What is the SMILES notation for [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine?
The canonical SMILES for [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine is COCc1cc(NN)c2cccc(C)c2n1.
What is the InChIKey of [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine?
The InChIKey is SHNMYVXTNQJZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-8-4-3-5-10-11(15-13)6-9(7-16-2)14-12(8)10/h3-6H,7,13H2,1-2H3,(H,14,15).
What are the key properties of [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine?
[2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine has a molecular weight of 217.27 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine is sourced from PubChem (CID 62319749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).