1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine

C11H19N3 — CID 175868063

IUPAC1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine
SMILESCC1=CC=CN(C)C1N1CCNCC1
InChIInChI=1S/C11H19N3/c1-10-4-3-7-13(2)11(10)14-8-5-12-6-9-14/h3-4,7,11-12H,5-6,8-9H2,1-2H3
InChIKeyJKRNLIRSESIMHZ-UHFFFAOYSA-N
MW193.29 g/mol
LogP0.62
Rot. Bonds1

About 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine

1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine (PubChem CID 175868063) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine.

Molecular Properties

Compound Name1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine
PubChem CID175868063
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine
SMILESCC1=CC=CN(C)C1N1CCNCC1
InChIInChI=1S/C11H19N3/c1-10-4-3-7-13(2)11(10)14-8-5-12-6-9-14/h3-4,7,11-12H,5-6,8-9H2,1-2H3
InChIKeyJKRNLIRSESIMHZ-UHFFFAOYSA-N
XLogP0.62
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine?
The IUPAC name of 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine (CID 175868063) is 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine.
What is the SMILES notation for 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine?
The canonical SMILES for 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine is CC1=CC=CN(C)C1N1CCNCC1.
What is the InChIKey of 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine?
The InChIKey is JKRNLIRSESIMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-10-4-3-7-13(2)11(10)14-8-5-12-6-9-14/h3-4,7,11-12H,5-6,8-9H2,1-2H3.
What are the key properties of 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine?
1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine has a molecular weight of 193.29 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethyl-2H-pyridin-2-yl)piperazine is sourced from PubChem (CID 175868063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).