1-(3,6-dimethylpyridazin-4-yl)ethanamine

C8H13N3 — CID 105082248

IUPAC1-(3,6-dimethylpyridazin-4-yl)ethanamine
SMILESCc1cc(C(C)N)c(C)nn1
InChIInChI=1S/C8H13N3/c1-5-4-8(6(2)9)7(3)11-10-5/h4,6H,9H2,1-3H3
InChIKeyQEFVFZJUMFMFCJ-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.11
Rot. Bonds1

About 1-(3,6-dimethylpyridazin-4-yl)ethanamine

1-(3,6-dimethylpyridazin-4-yl)ethanamine (PubChem CID 105082248) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(3,6-dimethylpyridazin-4-yl)ethanamine.

Molecular Properties

Compound Name1-(3,6-dimethylpyridazin-4-yl)ethanamine
PubChem CID105082248
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name1-(3,6-dimethylpyridazin-4-yl)ethanamine
SMILESCc1cc(C(C)N)c(C)nn1
InChIInChI=1S/C8H13N3/c1-5-4-8(6(2)9)7(3)11-10-5/h4,6H,9H2,1-3H3
InChIKeyQEFVFZJUMFMFCJ-UHFFFAOYSA-N
XLogP1.11
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,6-dimethylpyridazin-4-yl)-2-methylpropan-1-amine
CID 105078192
1-(3,6-dimethylpyridazin-4-yl)ethanol
CID 11491963
1-(3,6-dimethylpyridazin-4-yl)-2-methylprop-2-en-1-amine
CID 105163714
[1-(3,6-dimethylpyridazin-4-yl)-2-methylbutyl]hydrazine
CID 105325825
1-(3,6-dimethylpyridazin-4-yl)-5,5-dimethylhexan-1-amine
CID 114210905
1-(3,6-dimethylpyridazin-4-yl)propylhydrazine
CID 105281942
1-(3,6-dimethylpyridazin-4-yl)-2-propoxyethanamine
CID 105165411
1-(3,6-dimethylpyridazin-4-yl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanamine
CID 105160449
[1-(3,6-dimethylpyridazin-4-yl)-2-ethylbutyl]hydrazine
CID 105324133
2-(4-tert-butylphenyl)-1-(3,6-dimethylpyridazin-4-yl)ethanamine
CID 105136216
1-[5-(3,6-dimethylpyridazin-4-yl)-1,3,4-thiadiazol-2-yl]ethanamine
CID 104672976
1-(3,6-dimethylpyridazin-4-yl)-2-thiophen-3-ylethanamine
CID 105137583

Frequently Asked Questions

What is the IUPAC name of 1-(3,6-dimethylpyridazin-4-yl)ethanamine?
The IUPAC name of 1-(3,6-dimethylpyridazin-4-yl)ethanamine (CID 105082248) is 1-(3,6-dimethylpyridazin-4-yl)ethanamine.
What is the SMILES notation for 1-(3,6-dimethylpyridazin-4-yl)ethanamine?
The canonical SMILES for 1-(3,6-dimethylpyridazin-4-yl)ethanamine is Cc1cc(C(C)N)c(C)nn1.
What is the InChIKey of 1-(3,6-dimethylpyridazin-4-yl)ethanamine?
The InChIKey is QEFVFZJUMFMFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-5-4-8(6(2)9)7(3)11-10-5/h4,6H,9H2,1-3H3.
What are the key properties of 1-(3,6-dimethylpyridazin-4-yl)ethanamine?
1-(3,6-dimethylpyridazin-4-yl)ethanamine has a molecular weight of 151.21 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,6-dimethylpyridazin-4-yl)ethanamine is sourced from PubChem (CID 105082248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).