[1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite

C11H15FN4O3 — CID 155020988

IUPAC[1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite
SMILESCn1nc(NC(=O)N2CCC(OF)CC2)ccc1=O
InChIInChI=1S/C11H15FN4O3/c1-15-10(17)3-2-9(14-15)13-11(18)16-6-4-8(19-12)5-7-16/h2-3,8H,4-7H2,1H3,(H,13,14,18)
InChIKeyOZCYFHKOBMXVEN-UHFFFAOYSA-N
MW270.26 g/mol
LogP0.68
Rot. Bonds2

About [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite

[1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite (PubChem CID 155020988) has the molecular formula C11H15FN4O3 and a molecular weight of 270.26 g/mol. Its IUPAC name is [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite.

Molecular Properties

Compound Name[1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite
PubChem CID155020988
Molecular FormulaC11H15FN4O3
Molecular Weight270.26 g/mol
Exact Mass270.11
IUPAC Name[1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite
SMILESCn1nc(NC(=O)N2CCC(OF)CC2)ccc1=O
InChIInChI=1S/C11H15FN4O3/c1-15-10(17)3-2-9(14-15)13-11(18)16-6-4-8(19-12)5-7-16/h2-3,8H,4-7H2,1H3,(H,13,14,18)
InChIKeyOZCYFHKOBMXVEN-UHFFFAOYSA-N
XLogP0.68
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-methyl-6-oxopyridazin-3-yl)-4-oxopiperidine-1-carboxamide
CID 154662237
4-amino-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 154662473
N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 155021012
4-methoxy-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 156375699
4-hydroxy-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide
CID 156375727
1-methyl-1-(1-methylpiperidin-4-yl)-3-(6-oxo-1H-pyridazin-3-yl)urea
CID 108887250
N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide
CID 108887313
2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide
CID 108887359

Frequently Asked Questions

What is the IUPAC name of [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite?
The IUPAC name of [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite (CID 155020988) is [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite.
What is the SMILES notation for [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite?
The canonical SMILES for [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite is Cn1nc(NC(=O)N2CCC(OF)CC2)ccc1=O.
What is the InChIKey of [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite?
The InChIKey is OZCYFHKOBMXVEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN4O3/c1-15-10(17)3-2-9(14-15)13-11(18)16-6-4-8(19-12)5-7-16/h2-3,8H,4-7H2,1H3,(H,13,14,18).
What are the key properties of [1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite?
[1-[(1-methyl-6-oxopyridazin-3-yl)carbamoyl]piperidin-4-yl] hypofluorite has a molecular weight of 270.26 g/mol, XLogP of 0.68, 2 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-3-yl)carbamoyl]piperidin-4-yl] hypofluorite is sourced from PubChem (CID 155020988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).