6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile

C16H18N6 — CID 56777999

IUPAC6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile
SMILESCc1ccc(N2CCCC(Nc3ccc(C#N)cn3)C2)nn1
InChIInChI=1S/C16H18N6/c1-12-4-7-16(21-20-12)22-8-2-3-14(11-22)19-15-6-5-13(9-17)10-18-15/h4-7,10,14H,2-3,8,11H2,1H3,(H,18,19)
InChIKeyIZRKZNWBNKZMIR-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.13
Rot. Bonds3

About 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile

6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile (PubChem CID 56777999) has the molecular formula C16H18N6 and a molecular weight of 294.36 g/mol. Its IUPAC name is 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile
PubChem CID56777999
Molecular FormulaC16H18N6
Molecular Weight294.36 g/mol
Exact Mass294.16
IUPAC Name6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile
SMILESCc1ccc(N2CCCC(Nc3ccc(C#N)cn3)C2)nn1
InChIInChI=1S/C16H18N6/c1-12-4-7-16(21-20-12)22-8-2-3-14(11-22)19-15-6-5-13(9-17)10-18-15/h4-7,10,14H,2-3,8,11H2,1H3,(H,18,19)
InChIKeyIZRKZNWBNKZMIR-UHFFFAOYSA-N
XLogP2.13
TPSA77.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-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-[[1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile
CID 136560083
6-[[1-(2-fluorophenyl)piperidin-3-yl]amino]pyridine-3-carbonitrile
CID 133411893
4-fluoro-3-[[[(3R)-1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]methyl]benzonitrile
CID 97186348
1-methyl-N-[(3R)-1-(6-methylpyridazin-3-yl)piperidin-3-yl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 95342810
N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-4-(trifluoromethyl)pyridin-2-amine
CID 154737129
5-methyl-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 56777998
N-[1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]-6-(trifluoromethyl)pyrimidin-4-amine
CID 171704970
6-(4-methylazepan-1-yl)pyridine-3-carbonitrile
CID 62045126
6-[[(1S,3R)-3-methylcyclohexyl]amino]pyridine-3-carbonitrile
CID 93287060
N-[(3S)-1-(6-methylpyridazin-3-yl)piperidin-3-yl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 95331385
6-[[(3S)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]amino]pyridine-3-carbonitrile
CID 129368242
6-[[1-(pyridin-3-ylmethyl)piperidin-3-yl]amino]pyridine-3-carbonitrile
CID 122564334

Frequently Asked Questions

What is the IUPAC name of 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile?
The IUPAC name of 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile (CID 56777999) is 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile is Cc1ccc(N2CCCC(Nc3ccc(C#N)cn3)C2)nn1.
What is the InChIKey of 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile?
The InChIKey is IZRKZNWBNKZMIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6/c1-12-4-7-16(21-20-12)22-8-2-3-14(11-22)19-15-6-5-13(9-17)10-18-15/h4-7,10,14H,2-3,8,11H2,1H3,(H,18,19).
What are the key properties of 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile?
6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile has a molecular weight of 294.36 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]pyridine-3-carbonitrile is sourced from PubChem (CID 56777999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).