2-[2-(methoxymethyl)tetrazol-5-yl]pyridine

C8H9N5O — CID 4915943

IUPAC2-[2-(methoxymethyl)tetrazol-5-yl]pyridine
SMILESCOCn1nnc(-c2ccccn2)n1
InChIInChI=1S/C8H9N5O/c1-14-6-13-11-8(10-12-13)7-4-2-3-5-9-7/h2-5H,6H2,1H3
InChIKeyLPNQWVWHRHAPHD-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.34
Rot. Bonds3

About 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine

2-[2-(methoxymethyl)tetrazol-5-yl]pyridine (PubChem CID 4915943) has the molecular formula C8H9N5O and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine.

Molecular Properties

Compound Name2-[2-(methoxymethyl)tetrazol-5-yl]pyridine
PubChem CID4915943
Molecular FormulaC8H9N5O
Molecular Weight191.19 g/mol
Exact Mass191.08
IUPAC Name2-[2-(methoxymethyl)tetrazol-5-yl]pyridine
SMILESCOCn1nnc(-c2ccccn2)n1
InChIInChI=1S/C8H9N5O/c1-14-6-13-11-8(10-12-13)7-4-2-3-5-9-7/h2-5H,6H2,1H3
InChIKeyLPNQWVWHRHAPHD-UHFFFAOYSA-N
XLogP0.34
TPSA65.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine?
The IUPAC name of 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine (CID 4915943) is 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine.
What is the SMILES notation for 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine?
The canonical SMILES for 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine is COCn1nnc(-c2ccccn2)n1.
What is the InChIKey of 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine?
The InChIKey is LPNQWVWHRHAPHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O/c1-14-6-13-11-8(10-12-13)7-4-2-3-5-9-7/h2-5H,6H2,1H3.
What are the key properties of 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine?
2-[2-(methoxymethyl)tetrazol-5-yl]pyridine has a molecular weight of 191.19 g/mol, XLogP of 0.34, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methoxymethyl)tetrazol-5-yl]pyridine is sourced from PubChem (CID 4915943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).