1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine

C13H24N6 — CID 59088708

IUPAC1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine
SMILESCc1nnnn1CC1CCCC[C@H]1N1CCNCC1
InChIInChI=1S/C13H24N6/c1-11-15-16-17-19(11)10-12-4-2-3-5-13(12)18-8-6-14-7-9-18/h12-14H,2-10H2,1H3/t12?,13-/m1/s1
InChIKeyREFRKICPGJCIJA-ZGTCLIOFSA-N
MW264.38 g/mol
LogP0.45
Rot. Bonds3

About 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine

1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine (PubChem CID 59088708) has the molecular formula C13H24N6 and a molecular weight of 264.38 g/mol. Its IUPAC name is 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine
PubChem CID59088708
Molecular FormulaC13H24N6
Molecular Weight264.38 g/mol
Exact Mass264.21
IUPAC Name1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine
SMILESCc1nnnn1CC1CCCC[C@H]1N1CCNCC1
InChIInChI=1S/C13H24N6/c1-11-15-16-17-19(11)10-12-4-2-3-5-13(12)18-8-6-14-7-9-18/h12-14H,2-10H2,1H3/t12?,13-/m1/s1
InChIKeyREFRKICPGJCIJA-ZGTCLIOFSA-N
XLogP0.45
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 ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
The IUPAC name of 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine (CID 59088708) is 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine.
What is the SMILES notation for 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
The canonical SMILES for 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine is Cc1nnnn1CC1CCCC[C@H]1N1CCNCC1.
What is the InChIKey of 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
The InChIKey is REFRKICPGJCIJA-ZGTCLIOFSA-N. The full InChI is InChI=1S/C13H24N6/c1-11-15-16-17-19(11)10-12-4-2-3-5-13(12)18-8-6-14-7-9-18/h12-14H,2-10H2,1H3/t12?,13-/m1/s1.
What are the key properties of 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine?
1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine has a molecular weight of 264.38 g/mol, XLogP of 0.45, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-[(5-methyltetrazol-1-yl)methyl]cyclohexyl]piperazine is sourced from PubChem (CID 59088708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).