N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine

C14H24N4O — CID 66451853

IUPACN-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine
SMILESCCCOC1CCCN(c2cncc(CNC)n2)C1
InChIInChI=1S/C14H24N4O/c1-3-7-19-13-5-4-6-18(11-13)14-10-16-9-12(17-14)8-15-2/h9-10,13,15H,3-8,11H2,1-2H3
InChIKeyKKBZNVAFHYVABS-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.59
Rot. Bonds6

About N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine

N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine (PubChem CID 66451853) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine
PubChem CID66451853
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine
SMILESCCCOC1CCCN(c2cncc(CNC)n2)C1
InChIInChI=1S/C14H24N4O/c1-3-7-19-13-5-4-6-18(11-13)14-10-16-9-12(17-14)8-15-2/h9-10,13,15H,3-8,11H2,1-2H3
InChIKeyKKBZNVAFHYVABS-UHFFFAOYSA-N
XLogP1.59
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine (CID 66451853) is N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine is CCCOC1CCCN(c2cncc(CNC)n2)C1.
What is the InChIKey of N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine?
The InChIKey is KKBZNVAFHYVABS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-7-19-13-5-4-6-18(11-13)14-10-16-9-12(17-14)8-15-2/h9-10,13,15H,3-8,11H2,1-2H3.
What are the key properties of N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine?
N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine has a molecular weight of 264.37 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-(3-propoxypiperidin-1-yl)pyrazin-2-yl]methanamine is sourced from PubChem (CID 66451853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).