1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine

C12H21N5 — CID 141200245

IUPAC1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine
SMILESC1CCN(CC2(c3nn[nH]n3)CCCC2)CC1
InChIInChI=1S/C12H21N5/c1-4-8-17(9-5-1)10-12(6-2-3-7-12)11-13-15-16-14-11/h1-10H2,(H,13,14,15,16)
InChIKeyIEVRBBWXNUAEJD-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.50
Rot. Bonds3

About 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine

1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine (PubChem CID 141200245) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine.

Molecular Properties

Compound Name1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine
PubChem CID141200245
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine
SMILESC1CCN(CC2(c3nn[nH]n3)CCCC2)CC1
InChIInChI=1S/C12H21N5/c1-4-8-17(9-5-1)10-12(6-2-3-7-12)11-13-15-16-14-11/h1-10H2,(H,13,14,15,16)
InChIKeyIEVRBBWXNUAEJD-UHFFFAOYSA-N
XLogP1.50
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine?
The IUPAC name of 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine (CID 141200245) is 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine.
What is the SMILES notation for 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine?
The canonical SMILES for 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine is C1CCN(CC2(c3nn[nH]n3)CCCC2)CC1.
What is the InChIKey of 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine?
The InChIKey is IEVRBBWXNUAEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-4-8-17(9-5-1)10-12(6-2-3-7-12)11-13-15-16-14-11/h1-10H2,(H,13,14,15,16).
What are the key properties of 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine?
1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine has a molecular weight of 235.33 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(2H-tetrazol-5-yl)cyclopentyl]methyl]piperidine is sourced from PubChem (CID 141200245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).