1-(3,5-dimethyl-4-pyridinyl)piperazine

C11H17N3 — CID 75355584

IUPAC1-(3,5-dimethyl-4-pyridinyl)piperazine
SMILESCc1cncc(C)c1N1CCNCC1
InChIInChI=1S/C11H17N3/c1-9-7-13-8-10(2)11(9)14-5-3-12-4-6-14/h7-8,12H,3-6H2,1-2H3
InChIKeyFQSHCYOLEIVSHX-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.11
Rot. Bonds1

About 1-(3,5-dimethyl-4-pyridinyl)piperazine

1-(3,5-dimethyl-4-pyridinyl)piperazine (PubChem CID 75355584) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-(3,5-dimethyl-4-pyridinyl)piperazine.

Molecular Properties

Compound Name1-(3,5-dimethyl-4-pyridinyl)piperazine
PubChem CID75355584
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-(3,5-dimethyl-4-pyridinyl)piperazine
SMILESCc1cncc(C)c1N1CCNCC1
InChIInChI=1S/C11H17N3/c1-9-7-13-8-10(2)11(9)14-5-3-12-4-6-14/h7-8,12H,3-6H2,1-2H3
InChIKeyFQSHCYOLEIVSHX-UHFFFAOYSA-N
XLogP1.11
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethyl-4-pyridinyl)piperazine?
The IUPAC name of 1-(3,5-dimethyl-4-pyridinyl)piperazine (CID 75355584) is 1-(3,5-dimethyl-4-pyridinyl)piperazine.
What is the SMILES notation for 1-(3,5-dimethyl-4-pyridinyl)piperazine?
The canonical SMILES for 1-(3,5-dimethyl-4-pyridinyl)piperazine is Cc1cncc(C)c1N1CCNCC1.
What is the InChIKey of 1-(3,5-dimethyl-4-pyridinyl)piperazine?
The InChIKey is FQSHCYOLEIVSHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9-7-13-8-10(2)11(9)14-5-3-12-4-6-14/h7-8,12H,3-6H2,1-2H3.
What are the key properties of 1-(3,5-dimethyl-4-pyridinyl)piperazine?
1-(3,5-dimethyl-4-pyridinyl)piperazine has a molecular weight of 191.28 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethyl-4-pyridinyl)piperazine is sourced from PubChem (CID 75355584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).