3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine

C13H21N3 — CID 105157733

IUPAC3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine
SMILESCNC(CCC1CC1)c1cc(C)nnc1C
InChIInChI=1S/C13H21N3/c1-9-8-12(10(2)16-15-9)13(14-3)7-6-11-4-5-11/h8,11,13-14H,4-7H2,1-3H3
InChIKeyBJGYIEKUMBARNR-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.54
Rot. Bonds5

About 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine

3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine (PubChem CID 105157733) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine
PubChem CID105157733
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine
SMILESCNC(CCC1CC1)c1cc(C)nnc1C
InChIInChI=1S/C13H21N3/c1-9-8-12(10(2)16-15-9)13(14-3)7-6-11-4-5-11/h8,11,13-14H,4-7H2,1-3H3
InChIKeyBJGYIEKUMBARNR-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

2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine
CID 105152783
3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
CID 105157885
1-(3,6-dimethylpyridazin-4-yl)-N-methyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105187661
3-cyclopentyl-N-methyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990513
1-(4-bromo-3,5-dimethylphenyl)-3-cyclopropyl-N-methylpropan-1-amine
CID 114330463
3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine
CID 106791881
3-cyclopropyl-N-methyl-1-pyrimidin-5-ylpropan-1-amine
CID 102923524
1-(3,6-dimethylpyridazin-4-yl)-1-(2-ethylcyclohexyl)-N-methylmethanamine
CID 105151150
3-cyclopropyl-1-(2,5-dichlorothiophen-3-yl)-N-methylpropan-1-amine
CID 107968452
3-cyclopentyl-1-(2,4-dimethylphenyl)-N-methylpropan-1-amine
CID 43482676
1-(3,6-dimethylpyridazin-4-yl)propylhydrazine
CID 105281942
1-(3,6-dimethylpyridazin-4-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 105156981

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine?
The IUPAC name of 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine (CID 105157733) is 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine is CNC(CCC1CC1)c1cc(C)nnc1C.
What is the InChIKey of 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine?
The InChIKey is BJGYIEKUMBARNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9-8-12(10(2)16-15-9)13(14-3)7-6-11-4-5-11/h8,11,13-14H,4-7H2,1-3H3.
What are the key properties of 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine?
3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine 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 3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 105157733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).