N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine

C16H25N5 — CID 105187699

IUPACN-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine
SMILESCCNC(CCc1nccn1C)c1cc(C)nnc1CC
InChIInChI=1S/C16H25N5/c1-5-14-13(11-12(3)19-20-14)15(17-6-2)7-8-16-18-9-10-21(16)4/h9-11,15,17H,5-8H2,1-4H3
InChIKeyWMYWLHJAXGCRJQ-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.36
Rot. Bonds7

About N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine

N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine (PubChem CID 105187699) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine
PubChem CID105187699
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC NameN-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine
SMILESCCNC(CCc1nccn1C)c1cc(C)nnc1CC
InChIInChI=1S/C16H25N5/c1-5-14-13(11-12(3)19-20-14)15(17-6-2)7-8-16-18-9-10-21(16)4/h9-11,15,17H,5-8H2,1-4H3
InChIKeyWMYWLHJAXGCRJQ-UHFFFAOYSA-N
XLogP2.36
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105187716
N-ethyl-1-(3-ethyl-1-methylpyrazol-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 102812906
1-(3,6-dimethylpyridazin-4-yl)-N-methyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105187661
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-4,4-dimethylpentan-1-amine
CID 105140055
1-(2-bromo-3-methylphenyl)-N-ethyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 107985466
N-ethyl-3-(1-methylimidazol-2-yl)-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine
CID 105049697
[(3-ethyl-6-methylpyridazin-4-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105308332
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-thiophen-3-ylpropan-1-amine
CID 105147843
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)hex-4-yn-1-amine
CID 105181467
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)hex-5-yn-1-amine
CID 105179583
N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 104672104
N-ethyl-1-(3-fluorophenyl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 114529913

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine (CID 105187699) is N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine is CCNC(CCc1nccn1C)c1cc(C)nnc1CC.
What is the InChIKey of N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine?
The InChIKey is WMYWLHJAXGCRJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-5-14-13(11-12(3)19-20-14)15(17-6-2)7-8-16-18-9-10-21(16)4/h9-11,15,17H,5-8H2,1-4H3.
What are the key properties of N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine?
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine has a molecular weight of 287.41 g/mol, XLogP of 2.36, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine is sourced from PubChem (CID 105187699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).