4-(1-methoxy-1-phenylethyl)pyridazine

C13H14N2O — CID 13316259

IUPAC4-(1-methoxy-1-phenylethyl)pyridazine
SMILESCOC(C)(c1ccccc1)c1ccnnc1
InChIInChI=1S/C13H14N2O/c1-13(16-2,11-6-4-3-5-7-11)12-8-9-14-15-10-12/h3-10H,1-2H3
InChIKeyHXKGWJWTXDDNCC-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.39
Rot. Bonds3

About 4-(1-methoxy-1-phenylethyl)pyridazine

4-(1-methoxy-1-phenylethyl)pyridazine (PubChem CID 13316259) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-(1-methoxy-1-phenylethyl)pyridazine.

Molecular Properties

Compound Name4-(1-methoxy-1-phenylethyl)pyridazine
PubChem CID13316259
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name4-(1-methoxy-1-phenylethyl)pyridazine
SMILESCOC(C)(c1ccccc1)c1ccnnc1
InChIInChI=1S/C13H14N2O/c1-13(16-2,11-6-4-3-5-7-11)12-8-9-14-15-10-12/h3-10H,1-2H3
InChIKeyHXKGWJWTXDDNCC-UHFFFAOYSA-N
XLogP2.39
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Phenyl(4-pyridazinyl)methanol
CID 13205669
3-(a-Methoxybenzyl)pyridazine
CID 15684250
1-Phenyl-1-pyridazin-3-ylethanol
CID 15684261
4-(a-Methoxybenzyl)pyridazin
CID 13205671
2-(2,4-Difluorophenyl)-2-(1-[pyridazin-3-yl]ethyl)oxirane
CID 18956522
4-(3,4,5-Trifluoro-2-methoxyphenyl)pyridazine
CID 87198587
3-Methoxy-5-(2,4,6-trifluorophenyl)pyridazine
CID 90904981
3-Fluoro-4-(4-methoxyphenyl)pyridazine
CID 177702114
3-[Ethoxy(phenyl)methyl]pyridazine
CID 15684251
Diphenyl(pyridazin-4-yl)methanol
CID 11391365
(5-Methyl-4-pyridazinyl)phenylmethanol
CID 13205673
1-Phenyl-(4-pyridazinyl)ethanol
CID 13205675

Frequently Asked Questions

What is the IUPAC name of 4-(1-methoxy-1-phenylethyl)pyridazine?
The IUPAC name of 4-(1-methoxy-1-phenylethyl)pyridazine (CID 13316259) is 4-(1-methoxy-1-phenylethyl)pyridazine.
What is the SMILES notation for 4-(1-methoxy-1-phenylethyl)pyridazine?
The canonical SMILES for 4-(1-methoxy-1-phenylethyl)pyridazine is COC(C)(c1ccccc1)c1ccnnc1.
What is the InChIKey of 4-(1-methoxy-1-phenylethyl)pyridazine?
The InChIKey is HXKGWJWTXDDNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-13(16-2,11-6-4-3-5-7-11)12-8-9-14-15-10-12/h3-10H,1-2H3.
What are the key properties of 4-(1-methoxy-1-phenylethyl)pyridazine?
4-(1-methoxy-1-phenylethyl)pyridazine has a molecular weight of 214.27 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methoxy-1-phenylethyl)pyridazine is sourced from PubChem (CID 13316259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).