4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide

C18H22N4O3 — CID 91924018

IUPAC4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide
SMILESCOc1ccc(C(=O)NC2CCN(c3cnn(C)c(=O)c3)CC2)cc1
InChIInChI=1S/C18H22N4O3/c1-21-17(23)11-15(12-19-21)22-9-7-14(8-10-22)20-18(24)13-3-5-16(25-2)6-4-13/h3-6,11-12,14H,7-10H2,1-2H3,(H,20,24)
InChIKeyHHMUZGZUMBJXHL-UHFFFAOYSA-N
MW342.40 g/mol
LogP1.19
Rot. Bonds4

About 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide

4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide (PubChem CID 91924018) has the molecular formula C18H22N4O3 and a molecular weight of 342.40 g/mol. Its IUPAC name is 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide
PubChem CID91924018
Molecular FormulaC18H22N4O3
Molecular Weight342.40 g/mol
Exact Mass342.17
IUPAC Name4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide
SMILESCOc1ccc(C(=O)NC2CCN(c3cnn(C)c(=O)c3)CC2)cc1
InChIInChI=1S/C18H22N4O3/c1-21-17(23)11-15(12-19-21)22-9-7-14(8-10-22)20-18(24)13-3-5-16(25-2)6-4-13/h3-6,11-12,14H,7-10H2,1-2H3,(H,20,24)
InChIKeyHHMUZGZUMBJXHL-UHFFFAOYSA-N
XLogP1.19
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-fluoro-4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide
CID 91911758
N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]-1,3-benzodioxole-5-carboxamide
CID 91924029
N-[1-[1-(2-methoxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]-4-propan-2-ylbenzamide
CID 91924080
N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-4-methoxy-2-methylbenzamide
CID 91924053
N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]thiophene-2-carboxamide
CID 91924014
N-[1-[1-(cyclopropylmethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]-3-methoxybenzamide
CID 91911835
N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-3-fluoro-4-methoxybenzamide
CID 91911783
4-methoxy-N-(1-methylsulfonylpiperidin-4-yl)benzamide
CID 39999639
N-[1-(1-ethyl-6-oxopyridazin-4-yl)piperidin-4-yl]-2,6-dimethoxypyridine-3-carboxamide
CID 91911769
N-(4-methoxyphenyl)-2-[4-(1-methyl-6-oxopyridazin-4-yl)piperazin-1-yl]acetamide
CID 171998493
4-methoxy-N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]benzamide
CID 110821265
N-(4-methoxyphenyl)-1-(1-methyl-6-oxopyridazin-4-yl)piperidine-3-carboxamide
CID 53203894

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide?
The IUPAC name of 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide (CID 91924018) is 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide.
What is the SMILES notation for 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide?
The canonical SMILES for 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide is COc1ccc(C(=O)NC2CCN(c3cnn(C)c(=O)c3)CC2)cc1.
What is the InChIKey of 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide?
The InChIKey is HHMUZGZUMBJXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O3/c1-21-17(23)11-15(12-19-21)22-9-7-14(8-10-22)20-18(24)13-3-5-16(25-2)6-4-13/h3-6,11-12,14H,7-10H2,1-2H3,(H,20,24).
What are the key properties of 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide?
4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide has a molecular weight of 342.40 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]benzamide is sourced from PubChem (CID 91924018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).