1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide

C15H24N4O2 — CID 53203962

IUPAC1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide
SMILESCC(C)CNC(=O)C1CCCN(c2cnn(C)c(=O)c2)C1
InChIInChI=1S/C15H24N4O2/c1-11(2)8-16-15(21)12-5-4-6-19(10-12)13-7-14(20)18(3)17-9-13/h7,9,11-12H,4-6,8,10H2,1-3H3,(H,16,21)
InChIKeySCRRPTZPHMCCHK-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.77
Rot. Bonds4

About 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide

1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide (PubChem CID 53203962) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide
PubChem CID53203962
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide
SMILESCC(C)CNC(=O)C1CCCN(c2cnn(C)c(=O)c2)C1
InChIInChI=1S/C15H24N4O2/c1-11(2)8-16-15(21)12-5-4-6-19(10-12)13-7-14(20)18(3)17-9-13/h7,9,11-12H,4-6,8,10H2,1-3H3,(H,16,21)
InChIKeySCRRPTZPHMCCHK-UHFFFAOYSA-N
XLogP0.77
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide?
The IUPAC name of 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide (CID 53203962) is 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide is CC(C)CNC(=O)C1CCCN(c2cnn(C)c(=O)c2)C1.
What is the InChIKey of 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide?
The InChIKey is SCRRPTZPHMCCHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11(2)8-16-15(21)12-5-4-6-19(10-12)13-7-14(20)18(3)17-9-13/h7,9,11-12H,4-6,8,10H2,1-3H3,(H,16,21).
What are the key properties of 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide?
1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyl-6-oxopyridazin-4-yl)-N-(2-methylpropyl)piperidine-3-carboxamide is sourced from PubChem (CID 53203962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).