4-[(5-methyltetrazol-1-yl)methyl]piperidine

C8H15N5 — CID 82512154

IUPAC4-[(5-methyltetrazol-1-yl)methyl]piperidine
SMILESCc1nnnn1CC1CCNCC1
InChIInChI=1S/C8H15N5/c1-7-10-11-12-13(7)6-8-2-4-9-5-3-8/h8-9H,2-6H2,1H3
InChIKeyXXYZPIYQAKPVCQ-UHFFFAOYSA-N
MW181.24 g/mol
LogP-0.02
Rot. Bonds2

About 4-[(5-methyltetrazol-1-yl)methyl]piperidine

4-[(5-methyltetrazol-1-yl)methyl]piperidine (PubChem CID 82512154) has the molecular formula C8H15N5 and a molecular weight of 181.24 g/mol. Its IUPAC name is 4-[(5-methyltetrazol-1-yl)methyl]piperidine.

Molecular Properties

Compound Name4-[(5-methyltetrazol-1-yl)methyl]piperidine
PubChem CID82512154
Molecular FormulaC8H15N5
Molecular Weight181.24 g/mol
Exact Mass181.13
IUPAC Name4-[(5-methyltetrazol-1-yl)methyl]piperidine
SMILESCc1nnnn1CC1CCNCC1
InChIInChI=1S/C8H15N5/c1-7-10-11-12-13(7)6-8-2-4-9-5-3-8/h8-9H,2-6H2,1H3
InChIKeyXXYZPIYQAKPVCQ-UHFFFAOYSA-N
XLogP-0.02
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(5-methyltetrazol-1-yl)methyl]piperidine?
The IUPAC name of 4-[(5-methyltetrazol-1-yl)methyl]piperidine (CID 82512154) is 4-[(5-methyltetrazol-1-yl)methyl]piperidine.
What is the SMILES notation for 4-[(5-methyltetrazol-1-yl)methyl]piperidine?
The canonical SMILES for 4-[(5-methyltetrazol-1-yl)methyl]piperidine is Cc1nnnn1CC1CCNCC1.
What is the InChIKey of 4-[(5-methyltetrazol-1-yl)methyl]piperidine?
The InChIKey is XXYZPIYQAKPVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5/c1-7-10-11-12-13(7)6-8-2-4-9-5-3-8/h8-9H,2-6H2,1H3.
What are the key properties of 4-[(5-methyltetrazol-1-yl)methyl]piperidine?
4-[(5-methyltetrazol-1-yl)methyl]piperidine has a molecular weight of 181.24 g/mol, XLogP of -0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-methyltetrazol-1-yl)methyl]piperidine is sourced from PubChem (CID 82512154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).