6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one

C13H23N3O2 — CID 105061674

IUPAC6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one
SMILESCCCNC(CCC)Cn1nc(OC)ccc1=O
InChIInChI=1S/C13H23N3O2/c1-4-6-11(14-9-5-2)10-16-13(17)8-7-12(15-16)18-3/h7-8,11,14H,4-6,9-10H2,1-3H3
InChIKeyQKACCJDRMDFWAX-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.42
Rot. Bonds8

About 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one

6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one (PubChem CID 105061674) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one.

Molecular Properties

Compound Name6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one
PubChem CID105061674
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one
SMILESCCCNC(CCC)Cn1nc(OC)ccc1=O
InChIInChI=1S/C13H23N3O2/c1-4-6-11(14-9-5-2)10-16-13(17)8-7-12(15-16)18-3/h7-8,11,14H,4-6,9-10H2,1-3H3
InChIKeyQKACCJDRMDFWAX-UHFFFAOYSA-N
XLogP1.42
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-(propylamino)pentyl]pyrimidin-4-one
CID 63769697
2-(2,3-dihydroxypropyl)-6-methoxypyridazin-3-one
CID 105061939
5-methyl-2-[2-(propylamino)pentyl]pyridazin-3-one
CID 106548521
2-[2-(2-ethoxyethylamino)ethyl]-6-methoxypyridazin-3-one
CID 105062166
2-[2-(ethylamino)-2-(3-methylphenyl)ethyl]-6-methoxypyridazin-3-one
CID 105061640
1-ethyl-3-[2-(propylamino)pentyl]imidazol-2-one
CID 80580297
2-[2-(1-cyclopropylethylamino)ethyl]-6-methoxypyridazin-3-one
CID 105062157
2-[2-amino-2-(4-fluorophenyl)ethyl]-6-methoxypyridazin-3-one
CID 107523229
2-[2-hydroxy-2-(2,4,6-trimethylphenyl)ethyl]-6-methoxypyridazin-3-one
CID 105062059
6-methoxy-2-[2-(2-methylanilino)ethyl]pyridazin-3-one
CID 105062130
6-methoxy-2-[2-(methylaminomethyl)prop-2-enyl]pyridazin-3-one
CID 103073142
ethyl 3-(3-methoxy-6-oxopyridazin-1-yl)propanoate
CID 105061550

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one?
The IUPAC name of 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one (CID 105061674) is 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one.
What is the SMILES notation for 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one?
The canonical SMILES for 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one is CCCNC(CCC)Cn1nc(OC)ccc1=O.
What is the InChIKey of 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one?
The InChIKey is QKACCJDRMDFWAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-4-6-11(14-9-5-2)10-16-13(17)8-7-12(15-16)18-3/h7-8,11,14H,4-6,9-10H2,1-3H3.
What are the key properties of 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one?
6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one has a molecular weight of 253.35 g/mol, XLogP of 1.42, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-[2-(propylamino)pentyl]pyridazin-3-one is sourced from PubChem (CID 105061674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).