N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide

C16H26N4O — CID 133364227

IUPACN-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCCCC2CCC(C)C)nn1
InChIInChI=1S/C16H26N4O/c1-12(2)7-8-13-6-4-5-11-20(13)15-10-9-14(18-19-15)16(21)17-3/h9-10,12-13H,4-8,11H2,1-3H3,(H,17,21)
InChIKeyQFHFBMRHCWFUBN-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.63
Rot. Bonds5

About N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide

N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide (PubChem CID 133364227) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide
PubChem CID133364227
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCCCC2CCC(C)C)nn1
InChIInChI=1S/C16H26N4O/c1-12(2)7-8-13-6-4-5-11-20(13)15-10-9-14(18-19-15)16(21)17-3/h9-10,12-13H,4-8,11H2,1-3H3,(H,17,21)
InChIKeyQFHFBMRHCWFUBN-UHFFFAOYSA-N
XLogP2.63
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (4-CYCLOPROPYLBUTYL)AMIDE
CID 11178995
6-[4-(2-METHYLCYCLOHEXANECARBONYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-CYCLOPROPYLETHYL)AMIDE
CID 11338533
6-[4-(2-DIMETHYLAMINOBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-CYCLOPROPYLETHYL)AMIDE
CID 11339214
6-[4-(2,5-DIMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-CYCLOPROPYLETHYL)AMIDE
CID 11350306
6-[4-(3,3,3-TRIFLUORO-2-METHYL-2-TRIFLUOROMETHYLPROPIONYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-CYCLOPROPYLETHYL)AMIDE
CID 11442719
N-(2-cyclopropylethyl)-6-(4-(2-(trifluoromethyl)benzoyl)piperazin-1-yl)pyridazine-3-carboxamide
CID 11487680
6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (3-CYCLOPROPYLPROPYL)AMIDE
CID 11488029
6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid Pentylamide
CID 11698083
6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (3-METHYLBUTYL)AMIDE
CID 16035765
6-[4-(2-TRIFLUOROMETHYLBENZYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (3-METHYLBUTYL)AMIDE
CID 16733788
6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-PHENYLPROPYL)AMIDE
CID 67011239
6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid Hexylamide
CID 67012215

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide (CID 133364227) is N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide is CNC(=O)c1ccc(N2CCCCC2CCC(C)C)nn1.
What is the InChIKey of N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide?
The InChIKey is QFHFBMRHCWFUBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12(2)7-8-13-6-4-5-11-20(13)15-10-9-14(18-19-15)16(21)17-3/h9-10,12-13H,4-8,11H2,1-3H3,(H,17,21).
What are the key properties of N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide?
N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide is sourced from PubChem (CID 133364227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).