N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide

C15H22N4O2 — CID 53202029

IUPACN-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C15H22N4O2/c20-14-9-13(10-16-18-14)19-7-5-11(6-8-19)15(21)17-12-3-1-2-4-12/h9-12H,1-8H2,(H,17,21)(H,18,20)
InChIKeyVLFGYIZHYQDMGC-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.05
Rot. Bonds3

About N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide

N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide (PubChem CID 53202029) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
PubChem CID53202029
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(c2cn[nH]c(=O)c2)CC1
InChIInChI=1S/C15H22N4O2/c20-14-9-13(10-16-18-14)19-7-5-11(6-8-19)15(21)17-12-3-1-2-4-12/h9-12H,1-8H2,(H,17,21)(H,18,20)
InChIKeyVLFGYIZHYQDMGC-UHFFFAOYSA-N
XLogP1.05
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide (CID 53202029) is N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide is O=C(NC1CCCC1)C1CCN(c2cn[nH]c(=O)c2)CC1.
What is the InChIKey of N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide?
The InChIKey is VLFGYIZHYQDMGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-14-9-13(10-16-18-14)19-7-5-11(6-8-19)15(21)17-12-3-1-2-4-12/h9-12H,1-8H2,(H,17,21)(H,18,20).
What are the key properties of N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide?
N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(6-oxo-1H-pyridazin-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 53202029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).