2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol

C9H17N5O — CID 107046212

IUPAC2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol
SMILESCn1nnc(CC(O)C2CCNCC2)n1
InChIInChI=1S/C9H17N5O/c1-14-12-9(11-13-14)6-8(15)7-2-4-10-5-3-7/h7-8,10,15H,2-6H2,1H3
InChIKeyZLZUSOLFNRTAGF-UHFFFAOYSA-N
MW211.27 g/mol
LogP-0.89
Rot. Bonds3

About 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol

2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol (PubChem CID 107046212) has the molecular formula C9H17N5O and a molecular weight of 211.27 g/mol. Its IUPAC name is 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol.

Molecular Properties

Compound Name2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol
PubChem CID107046212
Molecular FormulaC9H17N5O
Molecular Weight211.27 g/mol
Exact Mass211.14
IUPAC Name2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol
SMILESCn1nnc(CC(O)C2CCNCC2)n1
InChIInChI=1S/C9H17N5O/c1-14-12-9(11-13-14)6-8(15)7-2-4-10-5-3-7/h7-8,10,15H,2-6H2,1H3
InChIKeyZLZUSOLFNRTAGF-UHFFFAOYSA-N
XLogP-0.89
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol?
The IUPAC name of 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol (CID 107046212) is 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol.
What is the SMILES notation for 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol?
The canonical SMILES for 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol is Cn1nnc(CC(O)C2CCNCC2)n1.
What is the InChIKey of 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol?
The InChIKey is ZLZUSOLFNRTAGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O/c1-14-12-9(11-13-14)6-8(15)7-2-4-10-5-3-7/h7-8,10,15H,2-6H2,1H3.
What are the key properties of 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol?
2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol has a molecular weight of 211.27 g/mol, XLogP of -0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyltetrazol-5-yl)-1-piperidin-4-ylethanol is sourced from PubChem (CID 107046212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).