2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine

C13H21N3 — CID 105152783

IUPAC2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine
SMILESCCNC(CC1CC1)c1cc(C)nnc1C
InChIInChI=1S/C13H21N3/c1-4-14-13(8-11-5-6-11)12-7-9(2)15-16-10(12)3/h7,11,13-14H,4-6,8H2,1-3H3
InChIKeyMXIFFQSEHDDEIR-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.54
Rot. Bonds5

About 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine

2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine (PubChem CID 105152783) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine
PubChem CID105152783
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine
SMILESCCNC(CC1CC1)c1cc(C)nnc1C
InChIInChI=1S/C13H21N3/c1-4-14-13(8-11-5-6-11)12-7-9(2)15-16-10(12)3/h7,11,13-14H,4-6,8H2,1-3H3
InChIKeyMXIFFQSEHDDEIR-UHFFFAOYSA-N
XLogP2.54
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
CID 105157145
N-[cyclohexyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
CID 105079539
3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine
CID 105157733
2-cyclopropyl-N-ethyl-1-(2-methylquinolin-4-yl)ethanamine
CID 105152893
N-[(3,6-dimethylpyridazin-4-yl)-(4-ethylcyclohexyl)methyl]propan-1-amine
CID 105155357
N-[2-cyclobutyl-1-(3-ethyl-6-methylpyridazin-4-yl)ethyl]propan-1-amine
CID 105151585
1-(3,6-dimethylpyridazin-4-yl)-N-ethyl-2-(2-methylphenyl)ethanamine
CID 105091614
1-(2-bromo-5-methylphenyl)-2-cyclopropyl-N-ethylethanamine
CID 104986405
1-(3,6-dimethylpyridazin-4-yl)propylhydrazine
CID 105281942
1-(3,6-dimethylpyridazin-4-yl)-N-ethyl-2-(1-ethylimidazol-2-yl)ethanamine
CID 105165788
2-(3-bromo-5-fluorophenyl)-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine
CID 105169361
2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine
CID 64906307

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine?
The IUPAC name of 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine (CID 105152783) is 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine?
The canonical SMILES for 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine is CCNC(CC1CC1)c1cc(C)nnc1C.
What is the InChIKey of 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine?
The InChIKey is MXIFFQSEHDDEIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-4-14-13(8-11-5-6-11)12-7-9(2)15-16-10(12)3/h7,11,13-14H,4-6,8H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine?
2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine has a molecular weight of 219.33 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine is sourced from PubChem (CID 105152783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).