4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine

C9H17N5O — CID 107044495

IUPAC4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine
SMILESCC1CCNCC1OCc1nnn(C)n1
InChIInChI=1S/C9H17N5O/c1-7-3-4-10-5-8(7)15-6-9-11-13-14(2)12-9/h7-8,10H,3-6H2,1-2H3
InChIKeyWNQJUUVIJFPARH-UHFFFAOYSA-N
MW211.27 g/mol
LogP-0.28
Rot. Bonds3

About 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine

4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine (PubChem CID 107044495) has the molecular formula C9H17N5O and a molecular weight of 211.27 g/mol. Its IUPAC name is 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine.

Molecular Properties

Compound Name4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine
PubChem CID107044495
Molecular FormulaC9H17N5O
Molecular Weight211.27 g/mol
Exact Mass211.14
IUPAC Name4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine
SMILESCC1CCNCC1OCc1nnn(C)n1
InChIInChI=1S/C9H17N5O/c1-7-3-4-10-5-8(7)15-6-9-11-13-14(2)12-9/h7-8,10H,3-6H2,1-2H3
InChIKeyWNQJUUVIJFPARH-UHFFFAOYSA-N
XLogP-0.28
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine?
The IUPAC name of 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine (CID 107044495) is 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine.
What is the SMILES notation for 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine?
The canonical SMILES for 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine is CC1CCNCC1OCc1nnn(C)n1.
What is the InChIKey of 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine?
The InChIKey is WNQJUUVIJFPARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O/c1-7-3-4-10-5-8(7)15-6-9-11-13-14(2)12-9/h7-8,10H,3-6H2,1-2H3.
What are the key properties of 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine?
4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine has a molecular weight of 211.27 g/mol, XLogP of -0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[(2-methyltetrazol-5-yl)methoxy]piperidine is sourced from PubChem (CID 107044495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).