N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine

C14H24N4 — CID 114080434

IUPACN,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine
SMILESCNC1(C)CCN(C(C)c2nccnc2C)CC1
InChIInChI=1S/C14H24N4/c1-11-13(17-8-7-16-11)12(2)18-9-5-14(3,15-4)6-10-18/h7-8,12,15H,5-6,9-10H2,1-4H3
InChIKeyFGUPVXWWRARQIA-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.92
Rot. Bonds3

About N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine

N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine (PubChem CID 114080434) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine
PubChem CID114080434
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine
SMILESCNC1(C)CCN(C(C)c2nccnc2C)CC1
InChIInChI=1S/C14H24N4/c1-11-13(17-8-7-16-11)12(2)18-9-5-14(3,15-4)6-10-18/h7-8,12,15H,5-6,9-10H2,1-4H3
InChIKeyFGUPVXWWRARQIA-UHFFFAOYSA-N
XLogP1.92
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine?
The IUPAC name of N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine (CID 114080434) is N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine.
What is the SMILES notation for N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine?
The canonical SMILES for N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine is CNC1(C)CCN(C(C)c2nccnc2C)CC1.
What is the InChIKey of N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine?
The InChIKey is FGUPVXWWRARQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-11-13(17-8-7-16-11)12(2)18-9-5-14(3,15-4)6-10-18/h7-8,12,15H,5-6,9-10H2,1-4H3.
What are the key properties of N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine?
N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-[1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine is sourced from PubChem (CID 114080434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).