5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine

C16H25N3 — CID 64930554

IUPAC5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine
SMILESCC1CNC(C2CCCCC2)CN1c1cccnc1
InChIInChI=1S/C16H25N3/c1-13-10-18-16(14-6-3-2-4-7-14)12-19(13)15-8-5-9-17-11-15/h5,8-9,11,13-14,16,18H,2-4,6-7,10,12H2,1H3
InChIKeyJHEUOAJYZKMNMS-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.83
Rot. Bonds2

About 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine

5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine (PubChem CID 64930554) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine.

Molecular Properties

Compound Name5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine
PubChem CID64930554
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine
SMILESCC1CNC(C2CCCCC2)CN1c1cccnc1
InChIInChI=1S/C16H25N3/c1-13-10-18-16(14-6-3-2-4-7-14)12-19(13)15-8-5-9-17-11-15/h5,8-9,11,13-14,16,18H,2-4,6-7,10,12H2,1H3
InChIKeyJHEUOAJYZKMNMS-UHFFFAOYSA-N
XLogP2.83
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine?
The IUPAC name of 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine (CID 64930554) is 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine.
What is the SMILES notation for 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine?
The canonical SMILES for 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine is CC1CNC(C2CCCCC2)CN1c1cccnc1.
What is the InChIKey of 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine?
The InChIKey is JHEUOAJYZKMNMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-13-10-18-16(14-6-3-2-4-7-14)12-19(13)15-8-5-9-17-11-15/h5,8-9,11,13-14,16,18H,2-4,6-7,10,12H2,1H3.
What are the key properties of 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine?
5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine has a molecular weight of 259.40 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2-methyl-1-pyridin-3-ylpiperazine is sourced from PubChem (CID 64930554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).