2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one

C18H26N4O3 — CID 128981232

IUPAC2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
SMILESCOCCN(C)c1cnn(C2CCCN(Cc3ccco3)C2)c(=O)c1
InChIInChI=1S/C18H26N4O3/c1-20(8-10-24-2)16-11-18(23)22(19-12-16)15-5-3-7-21(13-15)14-17-6-4-9-25-17/h4,6,9,11-12,15H,3,5,7-8,10,13-14H2,1-2H3
InChIKeyKROQKMURPOQOBZ-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.76
Rot. Bonds7

About 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one

2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one (PubChem CID 128981232) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one.

Molecular Properties

Compound Name2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
PubChem CID128981232
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
SMILESCOCCN(C)c1cnn(C2CCCN(Cc3ccco3)C2)c(=O)c1
InChIInChI=1S/C18H26N4O3/c1-20(8-10-24-2)16-11-18(23)22(19-12-16)15-5-3-7-21(13-15)14-17-6-4-9-25-17/h4,6,9,11-12,15H,3,5,7-8,10,13-14H2,1-2H3
InChIKeyKROQKMURPOQOBZ-UHFFFAOYSA-N
XLogP1.76
TPSA63.74 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one 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

5-[2-methoxyethyl(methyl)amino]-2-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridazin-3-one
CID 128981240
5-[2-methoxyethyl(methyl)amino]-2-[1-[(3-propan-2-yloxyphenyl)methyl]piperidin-3-yl]pyridazin-3-one
CID 128970049
2-[1-[1-(1,3-benzoxazol-2-yl)ethyl]piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
CID 128991965
5-[methyl(propan-2-yl)amino]-2-[(3R)-1-[(1-phenylimidazol-2-yl)methyl]piperidin-3-yl]pyridazin-3-one
CID 129323669
2-[1-(2-amino-2-methylpropyl)piperidin-3-yl]-5-[methyl(propan-2-yl)amino]pyridazin-3-one;hydrochloride
CID 120857935
2-[(3R)-1-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)methyl]piperidin-3-yl]-5-[methyl(propan-2-yl)amino]pyridazin-3-one
CID 129324233
5-[(3S)-3-hydroxypyrrolidin-1-yl]-2-[(3R)-1-[(3-methoxyphenyl)methyl]piperidin-3-yl]pyridazin-3-one
CID 129323751
2-[(4-bromophenyl)methyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
CID 114396920
(3S)-N,N-diethyl-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 764291
1-(furan-2-ylmethyl)-N,N-dimethylpiperidin-4-amine
CID 91664788
4-[(3S)-1-(furan-2-ylmethyl)piperidin-3-yl]-2-methyl-1H-pyrimidin-6-one
CID 136706410
2-[(3S)-1-(1-benzofuran-3-ylmethyl)piperidin-3-yl]-5-morpholin-4-ylpyridazin-3-one
CID 129323592

Frequently Asked Questions

What is the IUPAC name of 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
The IUPAC name of 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one (CID 128981232) is 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one.
What is the SMILES notation for 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
The canonical SMILES for 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one is COCCN(C)c1cnn(C2CCCN(Cc3ccco3)C2)c(=O)c1.
What is the InChIKey of 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
The InChIKey is KROQKMURPOQOBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-20(8-10-24-2)16-11-18(23)22(19-12-16)15-5-3-7-21(13-15)14-17-6-4-9-25-17/h4,6,9,11-12,15H,3,5,7-8,10,13-14H2,1-2H3.
What are the key properties of 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one has a molecular weight of 346.43 g/mol, XLogP of 1.76, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(furan-2-ylmethyl)piperidin-3-yl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one is sourced from PubChem (CID 128981232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).