6-(cyclohexylmethylamino)pyridazine-3-carbonitrile

C12H16N4 — CID 163350091

IUPAC6-(cyclohexylmethylamino)pyridazine-3-carbonitrile
SMILESN#Cc1ccc(NCC2CCCCC2)nn1
InChIInChI=1S/C12H16N4/c13-8-11-6-7-12(16-15-11)14-9-10-4-2-1-3-5-10/h6-7,10H,1-5,9H2,(H,14,16)
InChIKeyPCFHPSBDVZIPJK-UHFFFAOYSA-N
MW216.29 g/mol
LogP2.34
Rot. Bonds3

About 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile

6-(cyclohexylmethylamino)pyridazine-3-carbonitrile (PubChem CID 163350091) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile.

Molecular Properties

Compound Name6-(cyclohexylmethylamino)pyridazine-3-carbonitrile
PubChem CID163350091
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name6-(cyclohexylmethylamino)pyridazine-3-carbonitrile
SMILESN#Cc1ccc(NCC2CCCCC2)nn1
InChIInChI=1S/C12H16N4/c13-8-11-6-7-12(16-15-11)14-9-10-4-2-1-3-5-10/h6-7,10H,1-5,9H2,(H,14,16)
InChIKeyPCFHPSBDVZIPJK-UHFFFAOYSA-N
XLogP2.34
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(cyclohexylmethylamino)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-[(4-tert-butylcyclohexyl)methylamino]pyridazine-3-carbonitrile
CID 133420728
6-(cyclopentylamino)pyridazine-3-carbonitrile
CID 126988363
methyl 6-(cyclohexylmethylamino)pyridazine-3-carboxylate
CID 54918952
5-[[5-(cyclohexylmethylamino)-6-methylpyridazin-3-yl]amino]pyrazine-2-carbonitrile
CID 167633129
6-[[1-[6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methylamino]pyridazine-3-carbonitrile
CID 146084662
5-(cyclohexylmethoxy)pyridine-2-carbonitrile
CID 115487982
6-[3-(oxolan-3-yloxy)propylamino]pyridazine-3-carbonitrile
CID 133419653
6-[[1-(2-methoxyethyl)cyclopentyl]methylamino]pyridazine-3-carbonitrile
CID 133420230
6-chloro-N-[[1-(cyclopentylmethyl)piperidin-4-yl]methyl]pyridazin-3-amine
CID 91536558
6-(2-phenoxyethylamino)pyridazine-3-carbonitrile
CID 163348040
2-[[6-(cyclohexylmethylamino)-2-methylpyrimidin-4-yl]amino]acetonitrile
CID 115266821
3-(cyclooctylmethylamino)pyrazine-2-carbonitrile
CID 133283842

Frequently Asked Questions

What is the IUPAC name of 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile?
The IUPAC name of 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile (CID 163350091) is 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile.
What is the SMILES notation for 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile?
The canonical SMILES for 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile is N#Cc1ccc(NCC2CCCCC2)nn1.
What is the InChIKey of 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile?
The InChIKey is PCFHPSBDVZIPJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c13-8-11-6-7-12(16-15-11)14-9-10-4-2-1-3-5-10/h6-7,10H,1-5,9H2,(H,14,16).
What are the key properties of 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile?
6-(cyclohexylmethylamino)pyridazine-3-carbonitrile has a molecular weight of 216.29 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclohexylmethylamino)pyridazine-3-carbonitrile is sourced from PubChem (CID 163350091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).