5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine

C12H8ClN5O — CID 118191569

IUPAC5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine
SMILESClc1ccc(Oc2ccc(-c3nn[nH]n3)cc2)nc1
InChIInChI=1S/C12H8ClN5O/c13-9-3-6-11(14-7-9)19-10-4-1-8(2-5-10)12-15-17-18-16-12/h1-7H,(H,15,16,17,18)
InChIKeySDNQWRZYALPQJF-UHFFFAOYSA-N
MW273.68 g/mol
LogP2.71
Rot. Bonds3

About 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine

5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine (PubChem CID 118191569) has the molecular formula C12H8ClN5O and a molecular weight of 273.68 g/mol. Its IUPAC name is 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine.

Molecular Properties

Compound Name5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine
PubChem CID118191569
Molecular FormulaC12H8ClN5O
Molecular Weight273.68 g/mol
Exact Mass273.04
IUPAC Name5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine
SMILESClc1ccc(Oc2ccc(-c3nn[nH]n3)cc2)nc1
InChIInChI=1S/C12H8ClN5O/c13-9-3-6-11(14-7-9)19-10-4-1-8(2-5-10)12-15-17-18-16-12/h1-7H,(H,15,16,17,18)
InChIKeySDNQWRZYALPQJF-UHFFFAOYSA-N
XLogP2.71
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.68
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-2-(4-ethoxyphenoxy)pyridine
CID 66234109
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5-[4-[(3-chlorophenyl)methoxy]phenyl]-2H-tetrazole
CID 10613243
5-[4-[(2-chlorophenyl)methoxy]phenyl]-2H-tetrazole;hydrochloride
CID 163327284
3-amino-4-[5-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]tetrazol-2-yl]butanoic acid
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2-bromo-5-[(5-chloro-2-pyridinyl)oxy]pyridine
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methyl 2-[4-(2H-tetrazol-5-yl)phenoxy]acetate
CID 59205718
2-(3-bromo-4-fluorophenoxy)-5-chloropyridine
CID 83233863
5-[4-[2-[4-(2H-tetrazol-5-yl)phenyl]ethyl]phenyl]-2H-tetrazole
CID 15279617
5-[4-[(7-fluoro-1-methyl-2,3-dihydro-1H-inden-4-yl)oxy]phenyl]-2H-tetrazole
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5-tert-butyl-2-(4-chlorophenoxy)pyridine
CID 59464073
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CID 130262477

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine?
The IUPAC name of 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine (CID 118191569) is 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine.
What is the SMILES notation for 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine?
The canonical SMILES for 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine is Clc1ccc(Oc2ccc(-c3nn[nH]n3)cc2)nc1.
What is the InChIKey of 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine?
The InChIKey is SDNQWRZYALPQJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN5O/c13-9-3-6-11(14-7-9)19-10-4-1-8(2-5-10)12-15-17-18-16-12/h1-7H,(H,15,16,17,18).
What are the key properties of 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine?
5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine has a molecular weight of 273.68 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[4-(2H-tetrazol-5-yl)phenoxy]pyridine is sourced from PubChem (CID 118191569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).