N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine

C15H19N3 — CID 119062682

IUPACN,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine
SMILESCc1ccc(-c2ccc(C(C)N(C)C)cc2)nn1
InChIInChI=1S/C15H19N3/c1-11-5-10-15(17-16-11)14-8-6-13(7-9-14)12(2)18(3)4/h5-10,12H,1-4H3
InChIKeyQPQFLGDSKATNQZ-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.07
Rot. Bonds3

About N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine

N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine (PubChem CID 119062682) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine
PubChem CID119062682
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine
SMILESCc1ccc(-c2ccc(C(C)N(C)C)cc2)nn1
InChIInChI=1S/C15H19N3/c1-11-5-10-15(17-16-11)14-8-6-13(7-9-14)12(2)18(3)4/h5-10,12H,1-4H3
InChIKeyQPQFLGDSKATNQZ-UHFFFAOYSA-N
XLogP3.07
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine?
The IUPAC name of N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine (CID 119062682) is N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine.
What is the SMILES notation for N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine?
The canonical SMILES for N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine is Cc1ccc(-c2ccc(C(C)N(C)C)cc2)nn1.
What is the InChIKey of N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine?
The InChIKey is QPQFLGDSKATNQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-5-10-15(17-16-11)14-8-6-13(7-9-14)12(2)18(3)4/h5-10,12H,1-4H3.
What are the key properties of N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine?
N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine has a molecular weight of 241.34 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[4-(6-methylpyridazin-3-yl)phenyl]ethanamine is sourced from PubChem (CID 119062682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).