2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine

C12H20N4 — CID 63610642

IUPAC2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine
SMILESCCC1CN(c2ncccc2N)CCN1C
InChIInChI=1S/C12H20N4/c1-3-10-9-16(8-7-15(10)2)12-11(13)5-4-6-14-12/h4-6,10H,3,7-9,13H2,1-2H3
InChIKeyCQUZAPLXGOGYMC-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.19
Rot. Bonds2

About 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine

2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine (PubChem CID 63610642) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine
PubChem CID63610642
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine
SMILESCCC1CN(c2ncccc2N)CCN1C
InChIInChI=1S/C12H20N4/c1-3-10-9-16(8-7-15(10)2)12-11(13)5-4-6-14-12/h4-6,10H,3,7-9,13H2,1-2H3
InChIKeyCQUZAPLXGOGYMC-UHFFFAOYSA-N
XLogP1.19
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine?
The IUPAC name of 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine (CID 63610642) is 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine.
What is the SMILES notation for 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine?
The canonical SMILES for 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine is CCC1CN(c2ncccc2N)CCN1C.
What is the InChIKey of 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine?
The InChIKey is CQUZAPLXGOGYMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-10-9-16(8-7-15(10)2)12-11(13)5-4-6-14-12/h4-6,10H,3,7-9,13H2,1-2H3.
What are the key properties of 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine?
2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-4-methylpiperazin-1-yl)pyridin-3-amine is sourced from PubChem (CID 63610642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).