6-(2H-tetrazol-5-ylmethoxy)quinoline

C11H9N5O — CID 82081095

IUPAC6-(2H-tetrazol-5-ylmethoxy)quinoline
SMILESc1cnc2ccc(OCc3nn[nH]n3)cc2c1
InChIInChI=1S/C11H9N5O/c1-2-8-6-9(3-4-10(8)12-5-1)17-7-11-13-15-16-14-11/h1-6H,7H2,(H,13,14,15,16)
InChIKeyHXVUNSNSLVDVRP-UHFFFAOYSA-N
MW227.23 g/mol
LogP1.33
Rot. Bonds3

About 6-(2H-tetrazol-5-ylmethoxy)quinoline

6-(2H-tetrazol-5-ylmethoxy)quinoline (PubChem CID 82081095) has the molecular formula C11H9N5O and a molecular weight of 227.23 g/mol. Its IUPAC name is 6-(2H-tetrazol-5-ylmethoxy)quinoline.

Molecular Properties

Compound Name6-(2H-tetrazol-5-ylmethoxy)quinoline
PubChem CID82081095
Molecular FormulaC11H9N5O
Molecular Weight227.23 g/mol
Exact Mass227.08
IUPAC Name6-(2H-tetrazol-5-ylmethoxy)quinoline
SMILESc1cnc2ccc(OCc3nn[nH]n3)cc2c1
InChIInChI=1S/C11H9N5O/c1-2-8-6-9(3-4-10(8)12-5-1)17-7-11-13-15-16-14-11/h1-6H,7H2,(H,13,14,15,16)
InChIKeyHXVUNSNSLVDVRP-UHFFFAOYSA-N
XLogP1.33
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.23
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(2H-tetrazol-5-ylmethoxy)quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(4-fluorophenyl)methoxy]quinoline
CID 60595158
5-[(3,4-dimethylphenoxy)methyl]-2H-tetrazole
CID 82076912
[4-(quinolin-6-yloxymethyl)phenyl]methanol
CID 110005974
2-[[3-(2H-tetrazol-5-ylmethoxy)phenoxy]methyl]quinoline
CID 14650343
6-prop-2-enoxyquinoline
CID 21107330
2-quinolin-6-yloxyacetonitrile
CID 70448045
2-[[4-[(E)-2-[4-(2H-tetrazol-5-ylmethoxy)phenyl]ethenyl]phenoxy]methyl]quinoline
CID 19808901
5-[(3-bromo-4-methylphenoxy)methyl]-2H-tetrazole
CID 131046406
2-[[3-[(E)-2-[4-(2H-tetrazol-5-ylmethoxy)phenyl]ethenyl]phenoxy]methyl]quinoline
CID 19808909
6-(azetidin-3-ylmethoxy)quinoline
CID 86262198
3-methyl-5-(quinolin-6-yloxymethyl)-1,2-oxazole
CID 56820803
6-tridecoxyquinoline
CID 174908858

Frequently Asked Questions

What is the IUPAC name of 6-(2H-tetrazol-5-ylmethoxy)quinoline?
The IUPAC name of 6-(2H-tetrazol-5-ylmethoxy)quinoline (CID 82081095) is 6-(2H-tetrazol-5-ylmethoxy)quinoline.
What is the SMILES notation for 6-(2H-tetrazol-5-ylmethoxy)quinoline?
The canonical SMILES for 6-(2H-tetrazol-5-ylmethoxy)quinoline is c1cnc2ccc(OCc3nn[nH]n3)cc2c1.
What is the InChIKey of 6-(2H-tetrazol-5-ylmethoxy)quinoline?
The InChIKey is HXVUNSNSLVDVRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O/c1-2-8-6-9(3-4-10(8)12-5-1)17-7-11-13-15-16-14-11/h1-6H,7H2,(H,13,14,15,16).
What are the key properties of 6-(2H-tetrazol-5-ylmethoxy)quinoline?
6-(2H-tetrazol-5-ylmethoxy)quinoline has a molecular weight of 227.23 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2H-tetrazol-5-ylmethoxy)quinoline is sourced from PubChem (CID 82081095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).