8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one

C14H22N4O — CID 10192850

IUPAC8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
SMILESO=c1[nH]nc(CCN2CCCCC2)c2c1CCCN2
InChIInChI=1S/C14H22N4O/c19-14-11-5-4-7-15-13(11)12(16-17-14)6-10-18-8-2-1-3-9-18/h15H,1-10H2,(H,17,19)
InChIKeyRZRHBMHFTHHFPO-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.16
Rot. Bonds3

About 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one

8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one (PubChem CID 10192850) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one.

Molecular Properties

Compound Name8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
PubChem CID10192850
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
SMILESO=c1[nH]nc(CCN2CCCCC2)c2c1CCCN2
InChIInChI=1S/C14H22N4O/c19-14-11-5-4-7-15-13(11)12(16-17-14)6-10-18-8-2-1-3-9-18/h15H,1-10H2,(H,17,19)
InChIKeyRZRHBMHFTHHFPO-UHFFFAOYSA-N
XLogP1.16
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one with MolForge

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Related Compounds

4-methyl-5,6,7,8-tetrahydro-2H-pyrido[4,3-c]pyridazin-3-one
CID 23464669
8-[2-(ethylamino)ethyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
CID 59751875
N,N-diethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
CID 59751877
8-(ethylaminomethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
CID 59751889
8-butyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
CID 59751901
N-[(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)methyl]propanamide
CID 59751909
8-[[ethyl(methyl)amino]methyl]-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
CID 59751912
8-pentyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
CID 59751914
8-ethyl-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one
CID 59751917
N-ethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)acetamide
CID 59751919
N-ethyl-2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)-N-propan-2-ylacetamide
CID 59751921
N-[2-(5-oxo-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-8-yl)ethyl]propanamide
CID 59751935

Frequently Asked Questions

What is the IUPAC name of 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
The IUPAC name of 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one (CID 10192850) is 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one.
What is the SMILES notation for 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
The canonical SMILES for 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one is O=c1[nH]nc(CCN2CCCCC2)c2c1CCCN2.
What is the InChIKey of 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
The InChIKey is RZRHBMHFTHHFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c19-14-11-5-4-7-15-13(11)12(16-17-14)6-10-18-8-2-1-3-9-18/h15H,1-10H2,(H,17,19).
What are the key properties of 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one?
8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one has a molecular weight of 262.36 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-piperidin-1-ylethyl)-2,3,4,6-tetrahydro-1H-pyrido[2,3-d]pyridazin-5-one is sourced from PubChem (CID 10192850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).