2,2-dimethyl-6-pyridin-4-ylpiperazine

C11H17N3 — CID 82403116

IUPAC2,2-dimethyl-6-pyridin-4-ylpiperazine
SMILESCC1(C)CNCC(c2ccncc2)N1
InChIInChI=1S/C11H17N3/c1-11(2)8-13-7-10(14-11)9-3-5-12-6-4-9/h3-6,10,13-14H,7-8H2,1-2H3
InChIKeyDNVUPIWILGOSQW-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.09
Rot. Bonds1

About 2,2-dimethyl-6-pyridin-4-ylpiperazine

2,2-dimethyl-6-pyridin-4-ylpiperazine (PubChem CID 82403116) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2,2-dimethyl-6-pyridin-4-ylpiperazine.

Molecular Properties

Compound Name2,2-dimethyl-6-pyridin-4-ylpiperazine
PubChem CID82403116
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2,2-dimethyl-6-pyridin-4-ylpiperazine
SMILESCC1(C)CNCC(c2ccncc2)N1
InChIInChI=1S/C11H17N3/c1-11(2)8-13-7-10(14-11)9-3-5-12-6-4-9/h3-6,10,13-14H,7-8H2,1-2H3
InChIKeyDNVUPIWILGOSQW-UHFFFAOYSA-N
XLogP1.09
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-pyridin-4-ylpiperazine?
The IUPAC name of 2,2-dimethyl-6-pyridin-4-ylpiperazine (CID 82403116) is 2,2-dimethyl-6-pyridin-4-ylpiperazine.
What is the SMILES notation for 2,2-dimethyl-6-pyridin-4-ylpiperazine?
The canonical SMILES for 2,2-dimethyl-6-pyridin-4-ylpiperazine is CC1(C)CNCC(c2ccncc2)N1.
What is the InChIKey of 2,2-dimethyl-6-pyridin-4-ylpiperazine?
The InChIKey is DNVUPIWILGOSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-11(2)8-13-7-10(14-11)9-3-5-12-6-4-9/h3-6,10,13-14H,7-8H2,1-2H3.
What are the key properties of 2,2-dimethyl-6-pyridin-4-ylpiperazine?
2,2-dimethyl-6-pyridin-4-ylpiperazine has a molecular weight of 191.28 g/mol, XLogP of 1.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-pyridin-4-ylpiperazine is sourced from PubChem (CID 82403116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).