N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide

C18H19N5O — CID 109126028

IUPACN-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)Nc3ccc(C#N)cc3)nn2)C1
InChIInChI=1S/C18H19N5O/c1-13-3-2-10-23(12-13)17-9-8-16(21-22-17)18(24)20-15-6-4-14(11-19)5-7-15/h4-9,13H,2-3,10,12H2,1H3,(H,20,24)
InChIKeyKGZRUHALKBYCRR-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.84
Rot. Bonds3

About N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide

N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide (PubChem CID 109126028) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
PubChem CID109126028
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC NameN-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)Nc3ccc(C#N)cc3)nn2)C1
InChIInChI=1S/C18H19N5O/c1-13-3-2-10-23(12-13)17-9-8-16(21-22-17)18(24)20-15-6-4-14(11-19)5-7-15/h4-9,13H,2-3,10,12H2,1H3,(H,20,24)
InChIKeyKGZRUHALKBYCRR-UHFFFAOYSA-N
XLogP2.84
TPSA81.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide 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-(3-methylpiperidin-1-yl)-N-[4-(4-methylpiperidin-1-yl)phenyl]pyridazine-3-carboxamide
CID 109125996
N-tert-butyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109124840
N-(4-cyanophenyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109124224
N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109126021
N-butan-2-yl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109111616
1-[6-(phenylcarbamoyl)pyridazin-3-yl]piperidine-3-carboxylic acid
CID 122051199
N-(4-methylphenyl)-6-(4-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109113214
N-benzyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109117891
N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109125972
6-(3,5-dimethylpiperidin-1-yl)-N-phenylpyridazine-3-carboxamide
CID 133313211
methyl 4-chloro-3-[[6-(3-methylpiperidin-1-yl)pyridazine-3-carbonyl]amino]benzoate
CID 109125990
N-(4-cyanophenyl)-6-cyclopropylpyridazine-3-carboxamide
CID 113200315

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide (CID 109126028) is N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide is CC1CCCN(c2ccc(C(=O)Nc3ccc(C#N)cc3)nn2)C1.
What is the InChIKey of N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The InChIKey is KGZRUHALKBYCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O/c1-13-3-2-10-23(12-13)17-9-8-16(21-22-17)18(24)20-15-6-4-14(11-19)5-7-15/h4-9,13H,2-3,10,12H2,1H3,(H,20,24).
What are the key properties of N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 109126028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).