2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine

C12H20N4 — CID 83265203

IUPAC2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine
SMILESCCN1CCN(c2cc(N)c(C)cn2)CC1
InChIInChI=1S/C12H20N4/c1-3-15-4-6-16(7-5-15)12-8-11(13)10(2)9-14-12/h8-9H,3-7H2,1-2H3,(H2,13,14)
InChIKeyNRHAIIGKPFHSMD-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.11
Rot. Bonds2

About 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine

2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine (PubChem CID 83265203) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine.

Molecular Properties

Compound Name2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine
PubChem CID83265203
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine
SMILESCCN1CCN(c2cc(N)c(C)cn2)CC1
InChIInChI=1S/C12H20N4/c1-3-15-4-6-16(7-5-15)12-8-11(13)10(2)9-14-12/h8-9H,3-7H2,1-2H3,(H2,13,14)
InChIKeyNRHAIIGKPFHSMD-UHFFFAOYSA-N
XLogP1.11
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 ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine?
The IUPAC name of 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine (CID 83265203) is 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine.
What is the SMILES notation for 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine?
The canonical SMILES for 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine is CCN1CCN(c2cc(N)c(C)cn2)CC1.
What is the InChIKey of 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine?
The InChIKey is NRHAIIGKPFHSMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-15-4-6-16(7-5-15)12-8-11(13)10(2)9-14-12/h8-9H,3-7H2,1-2H3,(H2,13,14).
What are the key properties of 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine?
2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylpiperazin-1-yl)-5-methylpyridin-4-amine is sourced from PubChem (CID 83265203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).