1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine

C13H24N6 — CID 59088666

IUPAC1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine
SMILESCc1nnnn1CC1(N2CCNCC2)CCCCC1
InChIInChI=1S/C13H24N6/c1-12-15-16-17-19(12)11-13(5-3-2-4-6-13)18-9-7-14-8-10-18/h14H,2-11H2,1H3
InChIKeyGCBRBQIWZZUNPR-UHFFFAOYSA-N
MW264.38 g/mol
LogP0.59
Rot. Bonds3

About 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine

1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine (PubChem CID 59088666) has the molecular formula C13H24N6 and a molecular weight of 264.38 g/mol. Its IUPAC name is 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine.

Molecular Properties

Compound Name1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine
PubChem CID59088666
Molecular FormulaC13H24N6
Molecular Weight264.38 g/mol
Exact Mass264.21
IUPAC Name1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine
SMILESCc1nnnn1CC1(N2CCNCC2)CCCCC1
InChIInChI=1S/C13H24N6/c1-12-15-16-17-19(12)11-13(5-3-2-4-6-13)18-9-7-14-8-10-18/h14H,2-11H2,1H3
InChIKeyGCBRBQIWZZUNPR-UHFFFAOYSA-N
XLogP0.59
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
The IUPAC name of 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine (CID 59088666) is 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine.
What is the SMILES notation for 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
The canonical SMILES for 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine is Cc1nnnn1CC1(N2CCNCC2)CCCCC1.
What is the InChIKey of 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
The InChIKey is GCBRBQIWZZUNPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6/c1-12-15-16-17-19(12)11-13(5-3-2-4-6-13)18-9-7-14-8-10-18/h14H,2-11H2,1H3.
What are the key properties of 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine has a molecular weight of 264.38 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine is sourced from PubChem (CID 59088666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).