6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide

C16H26N4O — CID 109111233

IUPAC6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide
SMILESCCC1CCCCN1c1ccc(C(=O)NCC(C)C)nn1
InChIInChI=1S/C16H26N4O/c1-4-13-7-5-6-10-20(13)15-9-8-14(18-19-15)16(21)17-11-12(2)3/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,17,21)
InChIKeyTWNOJHMHKNKLSN-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.63
Rot. Bonds5

About 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide

6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide (PubChem CID 109111233) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide
PubChem CID109111233
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide
SMILESCCC1CCCCN1c1ccc(C(=O)NCC(C)C)nn1
InChIInChI=1S/C16H26N4O/c1-4-13-7-5-6-10-20(13)15-9-8-14(18-19-15)16(21)17-11-12(2)3/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,17,21)
InChIKeyTWNOJHMHKNKLSN-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

N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109115393
4-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109202928
N-methyl-6-[2-(3-methylbutyl)piperidin-1-yl]pyridazine-3-carboxamide
CID 133364227
ethyl 6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxylate
CID 121206169
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109123335
6-(2-ethylpiperidin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)pyridazine-3-carboxamide
CID 109125855
N-benzyl-6-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridazine-3-carboxamide
CID 109125114
6-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyridazine-3-carboxamide
CID 109125838
6-(2-ethylpiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109125825
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyrazine-2-carboxamide
CID 109287769
N-benzyl-N-ethyl-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109120599
6-[2-(aminomethyl)azepan-1-yl]pyridazine-3-carboxamide
CID 116640255

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide (CID 109111233) is 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide is CCC1CCCCN1c1ccc(C(=O)NCC(C)C)nn1.
What is the InChIKey of 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide?
The InChIKey is TWNOJHMHKNKLSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-4-13-7-5-6-10-20(13)15-9-8-14(18-19-15)16(21)17-11-12(2)3/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,17,21).
What are the key properties of 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide?
6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)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 6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109111233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).