6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile

C15H18N6 — CID 133421443

IUPAC6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
SMILESCN(C)CCN(Cc1ccccn1)c1ccc(C#N)nn1
InChIInChI=1S/C15H18N6/c1-20(2)9-10-21(12-14-5-3-4-8-17-14)15-7-6-13(11-16)18-19-15/h3-8H,9-10,12H2,1-2H3
InChIKeyUHABLQSVLAEBIC-UHFFFAOYSA-N
MW282.35 g/mol
LogP1.31
Rot. Bonds6

About 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile

6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile (PubChem CID 133421443) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile.

Molecular Properties

Compound Name6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
PubChem CID133421443
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
SMILESCN(C)CCN(Cc1ccccn1)c1ccc(C#N)nn1
InChIInChI=1S/C15H18N6/c1-20(2)9-10-21(12-14-5-3-4-8-17-14)15-7-6-13(11-16)18-19-15/h3-8H,9-10,12H2,1-2H3
InChIKeyUHABLQSVLAEBIC-UHFFFAOYSA-N
XLogP1.31
TPSA68.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
CID 133419199
2-[ethyl(pyridin-2-ylmethyl)amino]pyrimidine-4-carbonitrile
CID 107544863
copper;bis(N'-[2-(dimethylamino)ethyl]-N,N-dimethyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine);hydrogen peroxide
CID 58058036
N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N'-[2-(dimethylamino)ethyl]-N,N-dimethyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine;N,N-dimethyl-N',N'-bis(pyridin-2-ylmethyl)ethane-1,2-diamine;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 158625319
2-[methyl(pyridin-2-ylmethyl)amino]pyridine-4-carbonitrile
CID 43565692
N,N-dimethyl-N'-pyridin-2-yl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine chloride
CID 45114124
tris(acetonitrile);lutetium(3+);bis(1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine);triiodide
CID 139129489
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
N'-benzyl-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine;N'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine
CID 70976609
N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridazin-3-amine
CID 55055145
dizinc;bis(acetonitrile);4-[[4-[bis(pyridin-2-ylmethyl)amino]phenyl]methyl]-N,N-bis(pyridin-2-ylmethyl)aniline;tetrachloride
CID 71473529

Frequently Asked Questions

What is the IUPAC name of 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
The IUPAC name of 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile (CID 133421443) is 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile.
What is the SMILES notation for 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
The canonical SMILES for 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile is CN(C)CCN(Cc1ccccn1)c1ccc(C#N)nn1.
What is the InChIKey of 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
The InChIKey is UHABLQSVLAEBIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6/c1-20(2)9-10-21(12-14-5-3-4-8-17-14)15-7-6-13(11-16)18-19-15/h3-8H,9-10,12H2,1-2H3.
What are the key properties of 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile has a molecular weight of 282.35 g/mol, XLogP of 1.31, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile is sourced from PubChem (CID 133421443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).