(6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine

C14H19N3O2 — CID 55050862

IUPAC(6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine
SMILESCOc1cc2nc(C(C)C)cc(NN)c2cc1OC
InChIInChI=1S/C14H19N3O2/c1-8(2)10-6-12(17-15)9-5-13(18-3)14(19-4)7-11(9)16-10/h5-8H,15H2,1-4H3,(H,16,17)
InChIKeyVSTZNPAQNQFEEZ-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.66
Rot. Bonds4

About (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine

(6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine (PubChem CID 55050862) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine
PubChem CID55050862
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name(6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine
SMILESCOc1cc2nc(C(C)C)cc(NN)c2cc1OC
InChIInChI=1S/C14H19N3O2/c1-8(2)10-6-12(17-15)9-5-13(18-3)14(19-4)7-11(9)16-10/h5-8H,15H2,1-4H3,(H,16,17)
InChIKeyVSTZNPAQNQFEEZ-UHFFFAOYSA-N
XLogP2.66
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine?
The IUPAC name of (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine (CID 55050862) is (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine.
What is the SMILES notation for (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine?
The canonical SMILES for (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine is COc1cc2nc(C(C)C)cc(NN)c2cc1OC.
What is the InChIKey of (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine?
The InChIKey is VSTZNPAQNQFEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-8(2)10-6-12(17-15)9-5-13(18-3)14(19-4)7-11(9)16-10/h5-8H,15H2,1-4H3,(H,16,17).
What are the key properties of (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine?
(6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine has a molecular weight of 261.32 g/mol, XLogP of 2.66, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6,7-dimethoxy-2-propan-2-ylquinolin-4-yl)hydrazine is sourced from PubChem (CID 55050862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).