1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol

C15H25N3O2 — CID 104515174

IUPAC1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol
SMILESCCC(C)(C(O)c1nccnc1OC)N1CCCCC1
InChIInChI=1S/C15H25N3O2/c1-4-15(2,18-10-6-5-7-11-18)13(19)12-14(20-3)17-9-8-16-12/h8-9,13,19H,4-7,10-11H2,1-3H3
InChIKeyKGLDLAAVTVNTEQ-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.17
Rot. Bonds5

About 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol

1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol (PubChem CID 104515174) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol
PubChem CID104515174
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol
SMILESCCC(C)(C(O)c1nccnc1OC)N1CCCCC1
InChIInChI=1S/C15H25N3O2/c1-4-15(2,18-10-6-5-7-11-18)13(19)12-14(20-3)17-9-8-16-12/h8-9,13,19H,4-7,10-11H2,1-3H3
InChIKeyKGLDLAAVTVNTEQ-UHFFFAOYSA-N
XLogP2.17
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-(3-methoxypyrazin-2-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine
CID 104515805
1-(2-methoxyphenyl)-2-methyl-2-pyrrolidin-1-ylbutan-1-ol
CID 79069176
2-ethyl-1-(3-methoxypyrazin-2-yl)-2-phenylbutan-1-ol
CID 104515115
1-(3,4-dichlorophenyl)-2-methyl-2-piperidin-1-ylbutan-1-ol
CID 79064831
2-(azepan-1-yl)-1-(1-ethylimidazol-2-yl)-2-methylpropan-1-ol
CID 79051803
2-methyl-1-(5-methyl-3-pyridinyl)-2-piperidin-1-ylbutan-1-ol
CID 115374171
1-(5-fluoro-3-pyridinyl)-2-methyl-2-piperidin-1-ylbutan-1-ol
CID 79065583
2-methyl-2-piperidin-1-yl-1-(4-propylphenyl)butan-1-ol
CID 79060249
3,5-dimethyl-3-piperidin-1-ylheptan-4-ol
CID 79445766
1-(3-methoxypyrazin-2-yl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105123869
1-(3-fluoro-5-methylphenyl)-2-methyl-2-piperidin-1-ylbutan-1-ol
CID 79704324
1-[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-2-methyl-2-pyrrolidin-1-ylbutan-1-ol
CID 114644453

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol (CID 104515174) is 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol is CCC(C)(C(O)c1nccnc1OC)N1CCCCC1.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol?
The InChIKey is KGLDLAAVTVNTEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-15(2,18-10-6-5-7-11-18)13(19)12-14(20-3)17-9-8-16-12/h8-9,13,19H,4-7,10-11H2,1-3H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol?
1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol has a molecular weight of 279.38 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypyrazin-2-yl)-2-methyl-2-piperidin-1-ylbutan-1-ol is sourced from PubChem (CID 104515174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).