1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine

C15H27N5 — CID 3173824

IUPAC1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine
SMILESCC(C)C(c1nnnn1C1CCCC1)N1CCCCC1
InChIInChI=1S/C15H27N5/c1-12(2)14(19-10-6-3-7-11-19)15-16-17-18-20(15)13-8-4-5-9-13/h12-14H,3-11H2,1-2H3
InChIKeyGBVYLWLMDOIAAF-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.97
Rot. Bonds4

About 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine

1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine (PubChem CID 3173824) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine.

Molecular Properties

Compound Name1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine
PubChem CID3173824
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine
SMILESCC(C)C(c1nnnn1C1CCCC1)N1CCCCC1
InChIInChI=1S/C15H27N5/c1-12(2)14(19-10-6-3-7-11-19)15-16-17-18-20(15)13-8-4-5-9-13/h12-14H,3-11H2,1-2H3
InChIKeyGBVYLWLMDOIAAF-UHFFFAOYSA-N
XLogP2.97
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine?
The IUPAC name of 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine (CID 3173824) is 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine.
What is the SMILES notation for 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine?
The canonical SMILES for 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine is CC(C)C(c1nnnn1C1CCCC1)N1CCCCC1.
What is the InChIKey of 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine?
The InChIKey is GBVYLWLMDOIAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-12(2)14(19-10-6-3-7-11-19)15-16-17-18-20(15)13-8-4-5-9-13/h12-14H,3-11H2,1-2H3.
What are the key properties of 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine?
1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine has a molecular weight of 277.42 g/mol, XLogP of 2.97, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-cyclopentyltetrazol-5-yl)-2-methylpropyl]piperidine is sourced from PubChem (CID 3173824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).