N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide

C17H18Cl2N4O — CID 109126021

IUPACN-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3Cl)nn2)C1
InChIInChI=1S/C17H18Cl2N4O/c1-11-4-3-9-23(10-11)15-8-7-14(21-22-15)17(24)20-13-6-2-5-12(18)16(13)19/h2,5-8,11H,3-4,9-10H2,1H3,(H,20,24)
InChIKeyHRKFGLWCWGCKFX-UHFFFAOYSA-N
MW365.26 g/mol
LogP4.27
Rot. Bonds3

About N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide

N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide (PubChem CID 109126021) has the molecular formula C17H18Cl2N4O and a molecular weight of 365.26 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
PubChem CID109126021
Molecular FormulaC17H18Cl2N4O
Molecular Weight365.26 g/mol
Exact Mass364.09
IUPAC NameN-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCC1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3Cl)nn2)C1
InChIInChI=1S/C17H18Cl2N4O/c1-11-4-3-9-23(10-11)15-8-7-14(21-22-15)17(24)20-13-6-2-5-12(18)16(13)19/h2,5-8,11H,3-4,9-10H2,1H3,(H,20,24)
InChIKeyHRKFGLWCWGCKFX-UHFFFAOYSA-N
XLogP4.27
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109125972
methyl 4-chloro-3-[[6-(3-methylpiperidin-1-yl)pyridazine-3-carbonyl]amino]benzoate
CID 109125990
6-(4-acetylpiperazin-1-yl)-N-(2,3-dichlorophenyl)pyridazine-3-carboxamide
CID 109117200
N-(2-chlorophenyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 109111816
N-tert-butyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109124840
N-(2,3-dichlorophenyl)-6-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109099767
N-(2,3-dichlorophenyl)-6-(4-formylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109116912
6-(3-methylpiperidin-1-yl)-N-[4-(4-methylpiperidin-1-yl)phenyl]pyridazine-3-carboxamide
CID 109125996
N-(4-cyanophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109126028
N-butan-2-yl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109111616
N-benzyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109117891
N-(2-methylphenyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 109111795

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide (CID 109126021) is N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide is CC1CCCN(c2ccc(C(=O)Nc3cccc(Cl)c3Cl)nn2)C1.
What is the InChIKey of N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The InChIKey is HRKFGLWCWGCKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N4O/c1-11-4-3-9-23(10-11)15-8-7-14(21-22-15)17(24)20-13-6-2-5-12(18)16(13)19/h2,5-8,11H,3-4,9-10H2,1H3,(H,20,24).
What are the key properties of N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide has a molecular weight of 365.26 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 109126021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).