1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine

C15H27N3O2 — CID 105031280

IUPAC1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine
SMILESCNC(CC(C)C(C)(C)C)c1ncc(OC)nc1OC
InChIInChI=1S/C15H27N3O2/c1-10(15(2,3)4)8-11(16-5)13-14(20-7)18-12(19-6)9-17-13/h9-11,16H,8H2,1-7H3
InChIKeyUKHLOCVTRLKKBT-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.83
Rot. Bonds6

About 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine

1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine (PubChem CID 105031280) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine.

Molecular Properties

Compound Name1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine
PubChem CID105031280
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine
SMILESCNC(CC(C)C(C)(C)C)c1ncc(OC)nc1OC
InChIInChI=1S/C15H27N3O2/c1-10(15(2,3)4)8-11(16-5)13-14(20-7)18-12(19-6)9-17-13/h9-11,16H,8H2,1-7H3
InChIKeyUKHLOCVTRLKKBT-UHFFFAOYSA-N
XLogP2.83
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine?
The IUPAC name of 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine (CID 105031280) is 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine.
What is the SMILES notation for 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine?
The canonical SMILES for 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine is CNC(CC(C)C(C)(C)C)c1ncc(OC)nc1OC.
What is the InChIKey of 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine?
The InChIKey is UKHLOCVTRLKKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-10(15(2,3)4)8-11(16-5)13-14(20-7)18-12(19-6)9-17-13/h9-11,16H,8H2,1-7H3.
What are the key properties of 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine?
1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine has a molecular weight of 281.40 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxypyrazin-2-yl)-N,3,4,4-tetramethylpentan-1-amine is sourced from PubChem (CID 105031280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).