1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine

C11H20N4 — CID 19068068

IUPAC1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine
SMILESCC(N1C=CC(N)=CC1)N1CCNCC1
InChIInChI=1S/C11H20N4/c1-10(15-8-4-13-5-9-15)14-6-2-11(12)3-7-14/h2-3,6,10,13H,4-5,7-9,12H2,1H3
InChIKeyORVWCFLIXFXKNT-UHFFFAOYSA-N
MW208.31 g/mol
LogP-0.09
Rot. Bonds2

About 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine

1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine (PubChem CID 19068068) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine.

Molecular Properties

Compound Name1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine
PubChem CID19068068
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine
SMILESCC(N1C=CC(N)=CC1)N1CCNCC1
InChIInChI=1S/C11H20N4/c1-10(15-8-4-13-5-9-15)14-6-2-11(12)3-7-14/h2-3,6,10,13H,4-5,7-9,12H2,1H3
InChIKeyORVWCFLIXFXKNT-UHFFFAOYSA-N
XLogP-0.09
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine?
The IUPAC name of 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine (CID 19068068) is 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine.
What is the SMILES notation for 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine?
The canonical SMILES for 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine is CC(N1C=CC(N)=CC1)N1CCNCC1.
What is the InChIKey of 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine?
The InChIKey is ORVWCFLIXFXKNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-10(15-8-4-13-5-9-15)14-6-2-11(12)3-7-14/h2-3,6,10,13H,4-5,7-9,12H2,1H3.
What are the key properties of 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine?
1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine has a molecular weight of 208.31 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-piperazin-1-ylethyl)-2H-pyridin-4-amine is sourced from PubChem (CID 19068068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).