N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine

C15H18N4 — CID 79739278

IUPACN-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine
SMILESCCNc1ccc(C2CCCc3cccnc32)nn1
InChIInChI=1S/C15H18N4/c1-2-16-14-9-8-13(18-19-14)12-7-3-5-11-6-4-10-17-15(11)12/h4,6,8-10,12H,2-3,5,7H2,1H3,(H,16,19)
InChIKeyDSNHBBHORFBAKX-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.77
Rot. Bonds3

About N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine

N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine (PubChem CID 79739278) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine
PubChem CID79739278
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC NameN-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine
SMILESCCNc1ccc(C2CCCc3cccnc32)nn1
InChIInChI=1S/C15H18N4/c1-2-16-14-9-8-13(18-19-14)12-7-3-5-11-6-4-10-17-15(11)12/h4,6,8-10,12H,2-3,5,7H2,1H3,(H,16,19)
InChIKeyDSNHBBHORFBAKX-UHFFFAOYSA-N
XLogP2.77
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine?
The IUPAC name of N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine (CID 79739278) is N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine.
What is the SMILES notation for N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine?
The canonical SMILES for N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine is CCNc1ccc(C2CCCc3cccnc32)nn1.
What is the InChIKey of N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine?
The InChIKey is DSNHBBHORFBAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-2-16-14-9-8-13(18-19-14)12-7-3-5-11-6-4-10-17-15(11)12/h4,6,8-10,12H,2-3,5,7H2,1H3,(H,16,19).
What are the key properties of N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine?
N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine has a molecular weight of 254.34 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)pyridazin-3-amine is sourced from PubChem (CID 79739278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).