1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine

C15H19N3 — CID 157011002

IUPAC1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine
SMILESCc1cnnc(-c2ccc(CN(C)C)cc2)c1C
InChIInChI=1S/C15H19N3/c1-11-9-16-17-15(12(11)2)14-7-5-13(6-8-14)10-18(3)4/h5-9H,10H2,1-4H3
InChIKeyZZNCEBXGYYFEPP-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.82
Rot. Bonds3

About 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine

1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine (PubChem CID 157011002) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine
PubChem CID157011002
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine
SMILESCc1cnnc(-c2ccc(CN(C)C)cc2)c1C
InChIInChI=1S/C15H19N3/c1-11-9-16-17-15(12(11)2)14-7-5-13(6-8-14)10-18(3)4/h5-9H,10H2,1-4H3
InChIKeyZZNCEBXGYYFEPP-UHFFFAOYSA-N
XLogP2.82
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 ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine (CID 157011002) is 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine is Cc1cnnc(-c2ccc(CN(C)C)cc2)c1C.
What is the InChIKey of 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine?
The InChIKey is ZZNCEBXGYYFEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-9-16-17-15(12(11)2)14-7-5-13(6-8-14)10-18(3)4/h5-9H,10H2,1-4H3.
What are the key properties of 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine?
1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine has a molecular weight of 241.34 g/mol, XLogP of 2.82, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4,5-dimethylpyridazin-3-yl)phenyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 157011002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).