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

C13H13N5 — CID 133419199

IUPAC6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
SMILESCCN(Cc1ccccn1)c1ccc(C#N)nn1
InChIInChI=1S/C13H13N5/c1-2-18(10-12-5-3-4-8-15-12)13-7-6-11(9-14)16-17-13/h3-8H,2,10H2,1H3
InChIKeyVMAWYDJRHNVUMC-UHFFFAOYSA-N
MW239.28 g/mol
LogP1.77
Rot. Bonds4

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

6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile (PubChem CID 133419199) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile.

Molecular Properties

Compound Name6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
PubChem CID133419199
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC Name6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
SMILESCCN(Cc1ccccn1)c1ccc(C#N)nn1
InChIInChI=1S/C13H13N5/c1-2-18(10-12-5-3-4-8-15-12)13-7-6-11(9-14)16-17-13/h3-8H,2,10H2,1H3
InChIKeyVMAWYDJRHNVUMC-UHFFFAOYSA-N
XLogP1.77
TPSA65.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[2-(dimethylamino)ethyl-(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile
CID 133421443
2-[ethyl(pyridin-2-ylmethyl)amino]pyrimidine-4-carbonitrile
CID 107544863
6-[ethyl(pyridin-2-ylmethyl)amino]pyridine-3-carbaldehyde
CID 80632829
5-amino-6-[ethyl(pyridin-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 103468799
3-amino-5-[ethyl(pyridin-2-ylmethyl)amino]thiophene-2-carbonitrile
CID 103505486
N-ethyl-4,6-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 133404102
N-ethyl-6-hydrazinyl-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 80927004
3-amino-4-cyano-5-[ethyl(pyridin-2-ylmethyl)amino]thiophene-2-carboxamide
CID 103505469
6-chloro-N-ethyl-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716058
2-[methyl(pyridin-2-ylmethyl)amino]pyridine-4-carbonitrile
CID 43565692
3-amino-5-[ethyl(pyridin-2-ylmethyl)amino]-4-methylsulfanylthiophene-2-carbonitrile
CID 103505484
tris(acetonitrile);lutetium(3+);bis(1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine);triiodide
CID 139129489

Frequently Asked Questions

What is the IUPAC name of 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
The IUPAC name of 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile (CID 133419199) is 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile.
What is the SMILES notation for 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
The canonical SMILES for 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile is CCN(Cc1ccccn1)c1ccc(C#N)nn1.
What is the InChIKey of 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
The InChIKey is VMAWYDJRHNVUMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c1-2-18(10-12-5-3-4-8-15-12)13-7-6-11(9-14)16-17-13/h3-8H,2,10H2,1H3.
What are the key properties of 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile?
6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile has a molecular weight of 239.28 g/mol, XLogP of 1.77, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[ethyl(pyridin-2-ylmethyl)amino]pyridazine-3-carbonitrile is sourced from PubChem (CID 133419199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).