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

C19H24N4O2 — CID 109125972

IUPACN-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(N2CCCC(C)C2)nn1
InChIInChI=1S/C19H24N4O2/c1-3-25-17-9-5-4-8-15(17)20-19(24)16-10-11-18(22-21-16)23-12-6-7-14(2)13-23/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3,(H,20,24)
InChIKeyMIBHRWRQFRRHNY-UHFFFAOYSA-N
MW340.43 g/mol
LogP3.36
Rot. Bonds5

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

N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide (PubChem CID 109125972) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
PubChem CID109125972
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(N2CCCC(C)C2)nn1
InChIInChI=1S/C19H24N4O2/c1-3-25-17-9-5-4-8-15(17)20-19(24)16-10-11-18(22-21-16)23-12-6-7-14(2)13-23/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3,(H,20,24)
InChIKeyMIBHRWRQFRRHNY-UHFFFAOYSA-N
XLogP3.36
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109113251
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
ethyl 6-[(3S)-3-methylpiperidin-1-yl]pyridazine-3-carboxylate
CID 129495548
N-benzyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109117891
methyl 4-chloro-3-[[6-(3-methylpiperidin-1-yl)pyridazine-3-carbonyl]amino]benzoate
CID 109125990
1-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]-N-(2-ethoxyphenyl)piperidine-3-carboxamide
CID 90514602
N-tert-butyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109124840
6-(3-methylpiperidin-1-yl)-N-[4-(4-methylpiperidin-1-yl)phenyl]pyridazine-3-carboxamide
CID 109125996
N-(2-ethoxyphenyl)-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109056550
4-[6-(azepan-1-yl)pyridazin-3-yl]-N-(2-ethoxyphenyl)piperazine-1-carboxamide
CID 122334873
(3S)-N-cyclopropyl-1-[6-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanylpyridazin-3-yl]piperidine-3-carboxamide
CID 95092943

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide (CID 109125972) is N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide is CCOc1ccccc1NC(=O)c1ccc(N2CCCC(C)C2)nn1.
What is the InChIKey of N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
The InChIKey is MIBHRWRQFRRHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-3-25-17-9-5-4-8-15(17)20-19(24)16-10-11-18(22-21-16)23-12-6-7-14(2)13-23/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3,(H,20,24).
What are the key properties of N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide?
N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 109125972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).