2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine

C16H27N3 — CID 64861194

IUPAC2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine
SMILESCCC1CNC(CC)(CC)CN1Cc1ccccn1
InChIInChI=1S/C16H27N3/c1-4-15-11-18-16(5-2,6-3)13-19(15)12-14-9-7-8-10-17-14/h7-10,15,18H,4-6,11-13H2,1-3H3
InChIKeyAWUAMKAZGJMDIK-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.82
Rot. Bonds5

About 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine

2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine (PubChem CID 64861194) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine.

Molecular Properties

Compound Name2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine
PubChem CID64861194
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine
SMILESCCC1CNC(CC)(CC)CN1Cc1ccccn1
InChIInChI=1S/C16H27N3/c1-4-15-11-18-16(5-2,6-3)13-19(15)12-14-9-7-8-10-17-14/h7-10,15,18H,4-6,11-13H2,1-3H3
InChIKeyAWUAMKAZGJMDIK-UHFFFAOYSA-N
XLogP2.82
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5,5-triethyl-1-[(6-methyl-2-pyridinyl)methyl]piperazine
CID 64947930
2,5,5-triethyl-1-[(6-methoxy-2-pyridinyl)methyl]piperazine
CID 64861386
2-ethyl-5-methyl-1-(pyridin-2-ylmethyl)piperazine
CID 64844286
5,5-diethyl-2-methyl-1-(2-pyridin-2-ylethyl)piperazine
CID 64933169
1-[(2,6-difluorophenyl)methyl]-2,5,5-triethylpiperazine
CID 114934626
2,5,5-triethyl-1-[(1-methylimidazol-2-yl)methyl]piperazine
CID 64940812
2-[(5,5-diethyl-2-propylpiperazin-1-yl)methyl]pyrimidine
CID 64859659
2-[(2-ethylazetidin-1-yl)methyl]pyridine
CID 130678024
5-tert-butyl-2-ethyl-1-(pyridin-2-ylmethyl)piperazine
CID 64842793
2,5,5-triethyl-1-[(4-methyl-3-pyridinyl)methyl]piperazine
CID 114957678
5-cyclopropyl-2-ethyl-5-methyl-1-(2-pyridin-2-ylethyl)piperazine
CID 64935480
3-[(2,5,5-triethylpiperazin-1-yl)methyl]-1,2,4-oxadiazole
CID 114185177

Frequently Asked Questions

What is the IUPAC name of 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine?
The IUPAC name of 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine (CID 64861194) is 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine.
What is the SMILES notation for 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine?
The canonical SMILES for 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine is CCC1CNC(CC)(CC)CN1Cc1ccccn1.
What is the InChIKey of 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine?
The InChIKey is AWUAMKAZGJMDIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-4-15-11-18-16(5-2,6-3)13-19(15)12-14-9-7-8-10-17-14/h7-10,15,18H,4-6,11-13H2,1-3H3.
What are the key properties of 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine?
2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine has a molecular weight of 261.41 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,5-triethyl-1-(pyridin-2-ylmethyl)piperazine is sourced from PubChem (CID 64861194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).