N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine

C15H23N5 — CID 104672104

IUPACN-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
SMILESCCNC(c1cc(C)nnc1CC)c1nccn1CC
InChIInChI=1S/C15H23N5/c1-5-13-12(10-11(4)18-19-13)14(16-6-2)15-17-8-9-20(15)7-3/h8-10,14,16H,5-7H2,1-4H3
InChIKeySJEHOSHQAOIPGU-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.26
Rot. Bonds6

About N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine

N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine (PubChem CID 104672104) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
PubChem CID104672104
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC NameN-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
SMILESCCNC(c1cc(C)nnc1CC)c1nccn1CC
InChIInChI=1S/C15H23N5/c1-5-13-12(10-11(4)18-19-13)14(16-6-2)15-17-8-9-20(15)7-3/h8-10,14,16H,5-7H2,1-4H3
InChIKeySJEHOSHQAOIPGU-UHFFFAOYSA-N
XLogP2.26
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(3-ethyl-6-methylpyridazin-4-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105308332
N-[(3-ethyl-6-methylpyridazin-4-yl)-(4-ethylphenyl)methyl]ethanamine
CID 105121574
N-[(2,4-dichlorophenyl)-(1-ethylimidazol-2-yl)methyl]ethanamine
CID 54980096
1-(3,6-dimethylpyridazin-4-yl)-N-ethyl-2-(1-ethylimidazol-2-yl)ethanamine
CID 105165788
N-[(4-bromo-1-ethylpyrazol-5-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105182928
N-[(2-chlorofuran-3-yl)-(1-ethylimidazol-2-yl)methyl]ethanamine
CID 106689411
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105187699
N-[(3-ethyl-6-methylpyridazin-4-yl)-(4-methoxyphenyl)methyl]ethanamine
CID 105095248
N-[(3-ethyl-6-methylpyridazin-4-yl)-(3-ethylphenyl)methyl]ethanamine
CID 105171145
N-[(5-chlorothiophen-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105173432
N-[(1-ethylimidazol-2-yl)-(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 65199087
N-[(3-ethyl-6-methylpyridazin-4-yl)-(5-methoxy-3-pyridinyl)methyl]ethanamine
CID 105175289

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine?
The IUPAC name of N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine (CID 104672104) is N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine.
What is the SMILES notation for N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine?
The canonical SMILES for N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine is CCNC(c1cc(C)nnc1CC)c1nccn1CC.
What is the InChIKey of N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine?
The InChIKey is SJEHOSHQAOIPGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-5-13-12(10-11(4)18-19-13)14(16-6-2)15-17-8-9-20(15)7-3/h8-10,14,16H,5-7H2,1-4H3.
What are the key properties of N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine?
N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine has a molecular weight of 273.38 g/mol, XLogP of 2.26, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylimidazol-2-yl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine is sourced from PubChem (CID 104672104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).