5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine

C14H28N6 — CID 107056053

IUPAC5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine
SMILESCCCC1CNC(CC)(CC)CN1Cc1nnn(C)n1
InChIInChI=1S/C14H28N6/c1-5-8-12-9-15-14(6-2,7-3)11-20(12)10-13-16-18-19(4)17-13/h12,15H,5-11H2,1-4H3
InChIKeyLQTGXSAHURXJBO-UHFFFAOYSA-N
MW280.42 g/mol
LogP1.34
Rot. Bonds6

About 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine

5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine (PubChem CID 107056053) has the molecular formula C14H28N6 and a molecular weight of 280.42 g/mol. Its IUPAC name is 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine.

Molecular Properties

Compound Name5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine
PubChem CID107056053
Molecular FormulaC14H28N6
Molecular Weight280.42 g/mol
Exact Mass280.24
IUPAC Name5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine
SMILESCCCC1CNC(CC)(CC)CN1Cc1nnn(C)n1
InChIInChI=1S/C14H28N6/c1-5-8-12-9-15-14(6-2,7-3)11-20(12)10-13-16-18-19(4)17-13/h12,15H,5-11H2,1-4H3
InChIKeyLQTGXSAHURXJBO-UHFFFAOYSA-N
XLogP1.34
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(5,5-diethyl-2-propylpiperazin-1-yl)methyl]pyrimidine
CID 64859659
5,5-diethyl-1-(2-phenylethyl)-2-propylpiperazine
CID 64860235
2,2,5,5-tetraethyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine
CID 107056079
3-ethyl-3,7-dimethyl-1-[(2-methyltetrazol-5-yl)methyl]-1,4-diazepane
CID 107056288
5,5-diethyl-2-propyl-1-(2-propylsulfonylethyl)piperazine
CID 106733240
5-ethyl-5-methyl-1-[(1-methyltriazol-4-yl)methyl]-2-propylpiperazine
CID 107055835
7-methyl-1-[(2-methyltetrazol-5-yl)methyl]-3-propyl-1,4-diazepane
CID 107056267
2-butan-2-yl-5-cyclopropyl-5-methyl-1-[(2-methyltetrazol-5-yl)methyl]piperazine
CID 107056008
3-[(2,5,5-triethylpiperazin-1-yl)methyl]-1,2,4-oxadiazole
CID 114185177
2-[(5-cyclopropyl-5-methyl-2-propylpiperazin-1-yl)methyl]pyrimidine
CID 64876536
4-[(1-methyltriazol-4-yl)methyl]-3-propyl-1,4-diazaspiro[5.5]undecane
CID 107055925
3-propyl-4-(pyrimidin-2-ylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64878189

Frequently Asked Questions

What is the IUPAC name of 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine?
The IUPAC name of 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine (CID 107056053) is 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine.
What is the SMILES notation for 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine?
The canonical SMILES for 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine is CCCC1CNC(CC)(CC)CN1Cc1nnn(C)n1.
What is the InChIKey of 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine?
The InChIKey is LQTGXSAHURXJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N6/c1-5-8-12-9-15-14(6-2,7-3)11-20(12)10-13-16-18-19(4)17-13/h12,15H,5-11H2,1-4H3.
What are the key properties of 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine?
5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine has a molecular weight of 280.42 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diethyl-1-[(2-methyltetrazol-5-yl)methyl]-2-propylpiperazine is sourced from PubChem (CID 107056053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).