1-(2-methoxyethoxymethyl)tetrazole

C5H10N4O2 — CID 19986213

IUPAC1-(2-methoxyethoxymethyl)tetrazole
SMILESCOCCOCn1cnnn1
InChIInChI=1S/C5H10N4O2/c1-10-2-3-11-5-9-4-6-7-8-9/h4H,2-3,5H2,1H3
InChIKeyYIJKPVAMOPQRDE-UHFFFAOYSA-N
MW158.16 g/mol
LogP-0.71
Rot. Bonds5

About 1-(2-methoxyethoxymethyl)tetrazole

1-(2-methoxyethoxymethyl)tetrazole (PubChem CID 19986213) has the molecular formula C5H10N4O2 and a molecular weight of 158.16 g/mol. Its IUPAC name is 1-(2-methoxyethoxymethyl)tetrazole.

Molecular Properties

Compound Name1-(2-methoxyethoxymethyl)tetrazole
PubChem CID19986213
Molecular FormulaC5H10N4O2
Molecular Weight158.16 g/mol
Exact Mass158.08
IUPAC Name1-(2-methoxyethoxymethyl)tetrazole
SMILESCOCCOCn1cnnn1
InChIInChI=1S/C5H10N4O2/c1-10-2-3-11-5-9-4-6-7-8-9/h4H,2-3,5H2,1H3
InChIKeyYIJKPVAMOPQRDE-UHFFFAOYSA-N
XLogP-0.71
TPSA62.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-0.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxymethyl)tetrazole?
The IUPAC name of 1-(2-methoxyethoxymethyl)tetrazole (CID 19986213) is 1-(2-methoxyethoxymethyl)tetrazole.
What is the SMILES notation for 1-(2-methoxyethoxymethyl)tetrazole?
The canonical SMILES for 1-(2-methoxyethoxymethyl)tetrazole is COCCOCn1cnnn1.
What is the InChIKey of 1-(2-methoxyethoxymethyl)tetrazole?
The InChIKey is YIJKPVAMOPQRDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O2/c1-10-2-3-11-5-9-4-6-7-8-9/h4H,2-3,5H2,1H3.
What are the key properties of 1-(2-methoxyethoxymethyl)tetrazole?
1-(2-methoxyethoxymethyl)tetrazole has a molecular weight of 158.16 g/mol, XLogP of -0.71, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxymethyl)tetrazole is sourced from PubChem (CID 19986213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).