3-[1-(2-ethylphenyl)ethyl]pyridazine

C14H16N2 — CID 21387646

IUPAC3-[1-(2-ethylphenyl)ethyl]pyridazine
SMILESCCc1ccccc1C(C)c1cccnn1
InChIInChI=1S/C14H16N2/c1-3-12-7-4-5-8-13(12)11(2)14-9-6-10-15-16-14/h4-11H,3H2,1-2H3
InChIKeyAXICTOFXGDOOHF-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.19
Rot. Bonds3

About 3-[1-(2-ethylphenyl)ethyl]pyridazine

3-[1-(2-ethylphenyl)ethyl]pyridazine (PubChem CID 21387646) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 3-[1-(2-ethylphenyl)ethyl]pyridazine.

Molecular Properties

Compound Name3-[1-(2-ethylphenyl)ethyl]pyridazine
PubChem CID21387646
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name3-[1-(2-ethylphenyl)ethyl]pyridazine
SMILESCCc1ccccc1C(C)c1cccnn1
InChIInChI=1S/C14H16N2/c1-3-12-7-4-5-8-13(12)11(2)14-9-6-10-15-16-14/h4-11H,3H2,1-2H3
InChIKeyAXICTOFXGDOOHF-UHFFFAOYSA-N
XLogP3.19
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-pyridazin-3-ylpentan-3-amine
CID 63550355
(S)-(2-ethylphenyl)-pyridin-2-ylmethanol
CID 97292894
(R)-(2-ethylphenyl)-pyridin-2-ylmethanol
CID 97292895
1-pyridazin-3-ylethanamine
CID 69035378
2-(2-ethylphenyl)-N-methylpropan-1-amine
CID 105425338
ethanol;1-(2-ethylphenyl)ethanol
CID 174807968
1-(2-ethylphenyl)-2-methylpropan-1-amine
CID 55283279
1-ethyl-2-[(2S)-pentan-2-yl]benzene
CID 144927407
trichloro-[2-(2-ethylphenyl)propyl]silane
CID 69460492
ethyl 2-amino-2-pyridazin-3-ylacetate
CID 22062849
N-ethyl-1-(2-ethylphenyl)ethanamine
CID 115781037
1-(2-ethylphenyl)-3-methylbutan-1-ol
CID 63901974

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-ethylphenyl)ethyl]pyridazine?
The IUPAC name of 3-[1-(2-ethylphenyl)ethyl]pyridazine (CID 21387646) is 3-[1-(2-ethylphenyl)ethyl]pyridazine.
What is the SMILES notation for 3-[1-(2-ethylphenyl)ethyl]pyridazine?
The canonical SMILES for 3-[1-(2-ethylphenyl)ethyl]pyridazine is CCc1ccccc1C(C)c1cccnn1.
What is the InChIKey of 3-[1-(2-ethylphenyl)ethyl]pyridazine?
The InChIKey is AXICTOFXGDOOHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-3-12-7-4-5-8-13(12)11(2)14-9-6-10-15-16-14/h4-11H,3H2,1-2H3.
What are the key properties of 3-[1-(2-ethylphenyl)ethyl]pyridazine?
3-[1-(2-ethylphenyl)ethyl]pyridazine has a molecular weight of 212.30 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-ethylphenyl)ethyl]pyridazine is sourced from PubChem (CID 21387646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).