3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine

C17H31N3 — CID 105176711

IUPAC3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine
SMILESCCCNC(CC(CC)CC)c1cc(C)nnc1CC
InChIInChI=1S/C17H31N3/c1-6-10-18-17(12-14(7-2)8-3)15-11-13(5)19-20-16(15)9-4/h11,14,17-18H,6-10,12H2,1-5H3
InChIKeyWGGHTWUJRCDRLU-UHFFFAOYSA-N
MW277.46 g/mol
LogP4.21
Rot. Bonds9

About 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine

3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine (PubChem CID 105176711) has the molecular formula C17H31N3 and a molecular weight of 277.46 g/mol. Its IUPAC name is 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine.

Molecular Properties

Compound Name3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine
PubChem CID105176711
Molecular FormulaC17H31N3
Molecular Weight277.46 g/mol
Exact Mass277.25
IUPAC Name3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine
SMILESCCCNC(CC(CC)CC)c1cc(C)nnc1CC
InChIInChI=1S/C17H31N3/c1-6-10-18-17(12-14(7-2)8-3)15-11-13(5)19-20-16(15)9-4/h11,14,17-18H,6-10,12H2,1-5H3
InChIKeyWGGHTWUJRCDRLU-UHFFFAOYSA-N
XLogP4.21
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.46
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-6-methylpyridazin-4-yl)-N-propyloctan-1-amine
CID 105124682
N-[2-cyclobutyl-1-(3-ethyl-6-methylpyridazin-4-yl)ethyl]propan-1-amine
CID 105151585
[1-(3-ethyl-6-methylpyridazin-4-yl)-3-methylpentyl]hydrazine
CID 105298647
3-ethyl-1-(4-ethylthiadiazol-5-yl)-N-propylpentan-1-amine
CID 105176939
N-[1-(3,6-dimethylpyridazin-4-yl)-2-methoxyethyl]propan-1-amine
CID 105165710
1-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,3,4-oxadiazol-2-yl]-N-propylpropan-1-amine
CID 104672369
1-(1,5-dimethylpyrazol-4-yl)-3-ethyl-N-propylpentan-1-amine
CID 105176674
[1-(3-ethyl-6-methylpyridazin-4-yl)-3,5-dimethylhexyl]hydrazine
CID 114201917
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-4,4-dimethylpentan-1-amine
CID 105140055
1-(2,5-difluorophenyl)-3-ethyl-N-propylpentan-1-amine
CID 82922427
2-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)butan-1-ol
CID 105114654
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)hex-4-yn-1-amine
CID 105181467

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine?
The IUPAC name of 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine (CID 105176711) is 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine.
What is the SMILES notation for 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine?
The canonical SMILES for 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine is CCCNC(CC(CC)CC)c1cc(C)nnc1CC.
What is the InChIKey of 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine?
The InChIKey is WGGHTWUJRCDRLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3/c1-6-10-18-17(12-14(7-2)8-3)15-11-13(5)19-20-16(15)9-4/h11,14,17-18H,6-10,12H2,1-5H3.
What are the key properties of 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine?
3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine has a molecular weight of 277.46 g/mol, XLogP of 4.21, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-N-propylpentan-1-amine is sourced from PubChem (CID 105176711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).