2-(1-propan-2-yltetrazol-5-yl)piperidine

C9H17N5 — CID 84666405

IUPAC2-(1-propan-2-yltetrazol-5-yl)piperidine
SMILESCC(C)n1nnnc1C1CCCCN1
InChIInChI=1S/C9H17N5/c1-7(2)14-9(11-12-13-14)8-5-3-4-6-10-8/h7-8,10H,3-6H2,1-2H3
InChIKeyJVVHLFBDJZGEFN-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.07
Rot. Bonds2

About 2-(1-propan-2-yltetrazol-5-yl)piperidine

2-(1-propan-2-yltetrazol-5-yl)piperidine (PubChem CID 84666405) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-(1-propan-2-yltetrazol-5-yl)piperidine.

Molecular Properties

Compound Name2-(1-propan-2-yltetrazol-5-yl)piperidine
PubChem CID84666405
Molecular FormulaC9H17N5
Molecular Weight195.27 g/mol
Exact Mass195.15
IUPAC Name2-(1-propan-2-yltetrazol-5-yl)piperidine
SMILESCC(C)n1nnnc1C1CCCCN1
InChIInChI=1S/C9H17N5/c1-7(2)14-9(11-12-13-14)8-5-3-4-6-10-8/h7-8,10H,3-6H2,1-2H3
InChIKeyJVVHLFBDJZGEFN-UHFFFAOYSA-N
XLogP1.07
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-cyclopropyl-1-propan-2-yltetrazole
CID 139307361
2-(4-propan-2-yl-1,2,4-triazol-3-yl)piperidine
CID 62406030
2-(4-methyl-1,2,4-triazol-3-yl)piperidine
CID 62406028
N,4-dimethyl-5-piperidin-2-yl-1,2,4-triazol-3-amine
CID 112597261
2-(4,5-dimethyl-1,2,4-triazol-3-yl)piperidine;dihydrochloride
CID 154883622
2-(4-methyl-1,2,4-triazol-3-yl)azepane
CID 64562303
(2S)-2-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)piperidine
CID 104915216
(2S)-2-(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)piperidine
CID 104915219
2-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)azepane
CID 64561912
2-(azepan-2-yl)-1-propan-2-ylbenzimidazole
CID 64559378
(2R)-2-(4-cyclopropyl-1,2,4-triazol-3-yl)piperidine
CID 104915223
6-methyl-3-piperidin-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 117148558

Frequently Asked Questions

What is the IUPAC name of 2-(1-propan-2-yltetrazol-5-yl)piperidine?
The IUPAC name of 2-(1-propan-2-yltetrazol-5-yl)piperidine (CID 84666405) is 2-(1-propan-2-yltetrazol-5-yl)piperidine.
What is the SMILES notation for 2-(1-propan-2-yltetrazol-5-yl)piperidine?
The canonical SMILES for 2-(1-propan-2-yltetrazol-5-yl)piperidine is CC(C)n1nnnc1C1CCCCN1.
What is the InChIKey of 2-(1-propan-2-yltetrazol-5-yl)piperidine?
The InChIKey is JVVHLFBDJZGEFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5/c1-7(2)14-9(11-12-13-14)8-5-3-4-6-10-8/h7-8,10H,3-6H2,1-2H3.
What are the key properties of 2-(1-propan-2-yltetrazol-5-yl)piperidine?
2-(1-propan-2-yltetrazol-5-yl)piperidine has a molecular weight of 195.27 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propan-2-yltetrazol-5-yl)piperidine is sourced from PubChem (CID 84666405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).