4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine

C11H21N5O — CID 59442738

IUPAC4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine
SMILESCC(C)(C)c1nnnn1CCN1CCOCC1
InChIInChI=1S/C11H21N5O/c1-11(2,3)10-12-13-14-16(10)5-4-15-6-8-17-9-7-15/h4-9H2,1-3H3
InChIKeyFBVLEJQZBSRRNI-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.30
Rot. Bonds3

About 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine

4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine (PubChem CID 59442738) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine
PubChem CID59442738
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine
SMILESCC(C)(C)c1nnnn1CCN1CCOCC1
InChIInChI=1S/C11H21N5O/c1-11(2,3)10-12-13-14-16(10)5-4-15-6-8-17-9-7-15/h4-9H2,1-3H3
InChIKeyFBVLEJQZBSRRNI-UHFFFAOYSA-N
XLogP0.30
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine (CID 59442738) is 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine is CC(C)(C)c1nnnn1CCN1CCOCC1.
What is the InChIKey of 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine?
The InChIKey is FBVLEJQZBSRRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-11(2,3)10-12-13-14-16(10)5-4-15-6-8-17-9-7-15/h4-9H2,1-3H3.
What are the key properties of 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine?
4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine has a molecular weight of 239.32 g/mol, XLogP of 0.30, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-tert-butyltetrazol-1-yl)ethyl]morpholine is sourced from PubChem (CID 59442738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).