1-methyl-4-pyridin-4-ylpiperazine

C10H15N3 — CID 10035151

IUPAC1-methyl-4-pyridin-4-ylpiperazine
SMILESCN1CCN(c2ccncc2)CC1
InChIInChI=1S/C10H15N3/c1-12-6-8-13(9-7-12)10-2-4-11-5-3-10/h2-5H,6-9H2,1H3
InChIKeyNGHHVCGBOOCIBY-UHFFFAOYSA-N
MW177.25 g/mol
LogP0.83
Rot. Bonds1

About 1-methyl-4-pyridin-4-ylpiperazine

1-methyl-4-pyridin-4-ylpiperazine (PubChem CID 10035151) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 1-methyl-4-pyridin-4-ylpiperazine.

Molecular Properties

Compound Name1-methyl-4-pyridin-4-ylpiperazine
PubChem CID10035151
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name1-methyl-4-pyridin-4-ylpiperazine
SMILESCN1CCN(c2ccncc2)CC1
InChIInChI=1S/C10H15N3/c1-12-6-8-13(9-7-12)10-2-4-11-5-3-10/h2-5H,6-9H2,1H3
InChIKeyNGHHVCGBOOCIBY-UHFFFAOYSA-N
XLogP0.83
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-pyridin-4-ylpiperazine?
The IUPAC name of 1-methyl-4-pyridin-4-ylpiperazine (CID 10035151) is 1-methyl-4-pyridin-4-ylpiperazine.
What is the SMILES notation for 1-methyl-4-pyridin-4-ylpiperazine?
The canonical SMILES for 1-methyl-4-pyridin-4-ylpiperazine is CN1CCN(c2ccncc2)CC1.
What is the InChIKey of 1-methyl-4-pyridin-4-ylpiperazine?
The InChIKey is NGHHVCGBOOCIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-12-6-8-13(9-7-12)10-2-4-11-5-3-10/h2-5H,6-9H2,1H3.
What are the key properties of 1-methyl-4-pyridin-4-ylpiperazine?
1-methyl-4-pyridin-4-ylpiperazine has a molecular weight of 177.25 g/mol, XLogP of 0.83, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-pyridin-4-ylpiperazine is sourced from PubChem (CID 10035151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).