4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol

C11H18N2O3 — CID 105123882

IUPAC4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol
SMILESCOc1nccnc1C(O)CCC(C)OC
InChIInChI=1S/C11H18N2O3/c1-8(15-2)4-5-9(14)10-11(16-3)13-7-6-12-10/h6-9,14H,4-5H2,1-3H3
InChIKeyZYFZMIILEKWIIX-UHFFFAOYSA-N
MW226.28 g/mol
LogP1.33
Rot. Bonds6

About 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol

4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol (PubChem CID 105123882) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol.

Molecular Properties

Compound Name4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol
PubChem CID105123882
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol
SMILESCOc1nccnc1C(O)CCC(C)OC
InChIInChI=1S/C11H18N2O3/c1-8(15-2)4-5-9(14)10-11(16-3)13-7-6-12-10/h6-9,14H,4-5H2,1-3H3
InChIKeyZYFZMIILEKWIIX-UHFFFAOYSA-N
XLogP1.33
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-amine
CID 105178647
1-(3-methoxypyrazin-2-yl)-2-(2-methylpropylsulfanyl)ethanol
CID 104515130
1-(3-methoxypyrazin-2-yl)-3,4,4-trimethylpentan-1-ol
CID 115831089
1-(3-methoxypyrazin-2-yl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105123869
1-(3-methoxypyrazin-2-yl)-2-pyridin-2-ylethanol
CID 104515074
2-(tert-butylamino)-1-(3-methoxypyrazin-2-yl)ethanol
CID 104516709
1-(3-methoxypyrazin-2-yl)-3-(3-methylphenyl)propan-1-ol
CID 105124030
1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol
CID 113421532
1-(3-methoxypyrazin-2-yl)-2-(propylamino)ethanol
CID 104516706
1-(3-methoxypyrazin-2-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105123898
3-(3-methoxypyrazin-2-yl)butanoic acid
CID 104516745
(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol
CID 104514527

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol?
The IUPAC name of 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol (CID 105123882) is 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol.
What is the SMILES notation for 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol?
The canonical SMILES for 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol is COc1nccnc1C(O)CCC(C)OC.
What is the InChIKey of 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol?
The InChIKey is ZYFZMIILEKWIIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c1-8(15-2)4-5-9(14)10-11(16-3)13-7-6-12-10/h6-9,14H,4-5H2,1-3H3.
What are the key properties of 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol?
4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol has a molecular weight of 226.28 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol is sourced from PubChem (CID 105123882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).