2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine

C7H6ClN5O — CID 130590050

IUPAC2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine
SMILESClc1ccc(OCc2nn[nH]n2)cn1
InChIInChI=1S/C7H6ClN5O/c8-6-2-1-5(3-9-6)14-4-7-10-12-13-11-7/h1-3H,4H2,(H,10,11,12,13)
InChIKeyWVWFBNOXXGQWSH-UHFFFAOYSA-N
MW211.61 g/mol
LogP0.83
Rot. Bonds3

About 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine

2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine (PubChem CID 130590050) has the molecular formula C7H6ClN5O and a molecular weight of 211.61 g/mol. Its IUPAC name is 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine.

Molecular Properties

Compound Name2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine
PubChem CID130590050
Molecular FormulaC7H6ClN5O
Molecular Weight211.61 g/mol
Exact Mass211.03
IUPAC Name2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine
SMILESClc1ccc(OCc2nn[nH]n2)cn1
InChIInChI=1S/C7H6ClN5O/c8-6-2-1-5(3-9-6)14-4-7-10-12-13-11-7/h1-3H,4H2,(H,10,11,12,13)
InChIKeyWVWFBNOXXGQWSH-UHFFFAOYSA-N
XLogP0.83
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.61
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-[(3,4-dimethylphenoxy)methyl]-2H-tetrazole
CID 82076912
5-[(3,5-dimethylphenoxy)methyl]-2H-tetrazole
CID 82076911
5-[(3-bromo-4-methylphenoxy)methyl]-2H-tetrazole
CID 131046406
2-chloro-5-(1H-imidazol-2-ylmethoxy)pyridine
CID 130604271
6-(2H-tetrazol-5-ylmethoxy)quinoline
CID 82081095
5-[[4-(3,4-dimethylpentyl)phenoxy]methyl]-2H-tetrazole
CID 20673419
2-[(6-chloro-3-pyridinyl)oxy]ethanol
CID 22036297
(6-chloro-3-pyridinyl)oxymethyl-trimethylsilane
CID 130680161
5-[(6-chloro-3-pyridinyl)oxymethyl]-1,3-thiazole
CID 112645504
5-[(2-methoxyphenoxy)methyl]-2H-tetrazole
CID 5306162
5-[[4-[3-(2-chlorophenyl)sulfonylpropyl]phenoxy]methyl]-2H-tetrazole
CID 67947493
4-(2-chlorophenyl)-N-[4-(2H-tetrazol-5-ylmethoxy)phenyl]-1,3-thiazol-2-amine
CID 25024578

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine?
The IUPAC name of 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine (CID 130590050) is 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine.
What is the SMILES notation for 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine?
The canonical SMILES for 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine is Clc1ccc(OCc2nn[nH]n2)cn1.
What is the InChIKey of 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine?
The InChIKey is WVWFBNOXXGQWSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN5O/c8-6-2-1-5(3-9-6)14-4-7-10-12-13-11-7/h1-3H,4H2,(H,10,11,12,13).
What are the key properties of 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine?
2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine has a molecular weight of 211.61 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(2H-tetrazol-5-ylmethoxy)pyridine is sourced from PubChem (CID 130590050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).