4-(1-benzyltetrazol-5-yl)piperidine

C13H17N5 — CID 84703981

IUPAC4-(1-benzyltetrazol-5-yl)piperidine
SMILESc1ccc(Cn2nnnc2C2CCNCC2)cc1
InChIInChI=1S/C13H17N5/c1-2-4-11(5-3-1)10-18-13(15-16-17-18)12-6-8-14-9-7-12/h1-5,12,14H,6-10H2
InChIKeyGWIDLUBKCMKORY-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.19
Rot. Bonds3

About 4-(1-benzyltetrazol-5-yl)piperidine

4-(1-benzyltetrazol-5-yl)piperidine (PubChem CID 84703981) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-(1-benzyltetrazol-5-yl)piperidine.

Molecular Properties

Compound Name4-(1-benzyltetrazol-5-yl)piperidine
PubChem CID84703981
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name4-(1-benzyltetrazol-5-yl)piperidine
SMILESc1ccc(Cn2nnnc2C2CCNCC2)cc1
InChIInChI=1S/C13H17N5/c1-2-4-11(5-3-1)10-18-13(15-16-17-18)12-6-8-14-9-7-12/h1-5,12,14H,6-10H2
InChIKeyGWIDLUBKCMKORY-UHFFFAOYSA-N
XLogP1.19
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1-benzyltetrazol-5-yl)piperidine?
The IUPAC name of 4-(1-benzyltetrazol-5-yl)piperidine (CID 84703981) is 4-(1-benzyltetrazol-5-yl)piperidine.
What is the SMILES notation for 4-(1-benzyltetrazol-5-yl)piperidine?
The canonical SMILES for 4-(1-benzyltetrazol-5-yl)piperidine is c1ccc(Cn2nnnc2C2CCNCC2)cc1.
What is the InChIKey of 4-(1-benzyltetrazol-5-yl)piperidine?
The InChIKey is GWIDLUBKCMKORY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5/c1-2-4-11(5-3-1)10-18-13(15-16-17-18)12-6-8-14-9-7-12/h1-5,12,14H,6-10H2.
What are the key properties of 4-(1-benzyltetrazol-5-yl)piperidine?
4-(1-benzyltetrazol-5-yl)piperidine has a molecular weight of 243.31 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-benzyltetrazol-5-yl)piperidine is sourced from PubChem (CID 84703981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).