2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one

C12H21N3O2 — CID 105061624

IUPAC2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one
SMILESCCCC(Cn1nc(OC)ccc1=O)NCC
InChIInChI=1S/C12H21N3O2/c1-4-6-10(13-5-2)9-15-12(16)8-7-11(14-15)17-3/h7-8,10,13H,4-6,9H2,1-3H3
InChIKeySCUBLRBBSMRVTP-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.03
Rot. Bonds7

About 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one

2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one (PubChem CID 105061624) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one.

Molecular Properties

Compound Name2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one
PubChem CID105061624
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one
SMILESCCCC(Cn1nc(OC)ccc1=O)NCC
InChIInChI=1S/C12H21N3O2/c1-4-6-10(13-5-2)9-15-12(16)8-7-11(14-15)17-3/h7-8,10,13H,4-6,9H2,1-3H3
InChIKeySCUBLRBBSMRVTP-UHFFFAOYSA-N
XLogP1.03
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-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

2-(3-Amino-1,1,1-trifluoropropan-2-yl)-6-methoxypyridazin-3-one
CID 105061442
2-[2-(Propylamino)pentyl]pyridazin-3-one
CID 62849954
2-[2-(Ethylamino)pentyl]pyridazin-3-one
CID 62849955
2-[2-(Methylamino)pentyl]pyridazin-3-one
CID 62849956
6-methoxy-2-[[(2S)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 102819960
6-methoxy-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 102819961
6-Methoxy-2-[2-[(propan-2-ylamino)methyl]prop-2-enyl]pyridazin-3-one
CID 103073143
2-[2-[(Cyclopropylamino)methyl]prop-2-enyl]-6-methoxypyridazin-3-one
CID 103073144
2-(2-Aminoethyl)-6-methoxypyridazin-3-one
CID 105061489
2-(4-Aminobutyl)-6-methoxypyridazin-3-one
CID 105061500
2-(3-Aminopropyl)-6-methoxypyridazin-3-one
CID 105061504
2-(5-Aminopentyl)-6-methoxypyridazin-3-one
CID 105061512

Frequently Asked Questions

What is the IUPAC name of 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one?
The IUPAC name of 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one (CID 105061624) is 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one.
What is the SMILES notation for 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one?
The canonical SMILES for 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one is CCCC(Cn1nc(OC)ccc1=O)NCC.
What is the InChIKey of 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one?
The InChIKey is SCUBLRBBSMRVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-4-6-10(13-5-2)9-15-12(16)8-7-11(14-15)17-3/h7-8,10,13H,4-6,9H2,1-3H3.
What are the key properties of 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one?
2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one has a molecular weight of 239.32 g/mol, XLogP of 1.03, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(ethylamino)pentyl]-6-methoxypyridazin-3-one is sourced from PubChem (CID 105061624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).