1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole

C15H13FN4O2 — CID 26037458

IUPAC1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole
SMILESCOc1ccc(F)cc1COc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H13FN4O2/c1-21-15-7-2-12(16)8-11(15)9-22-14-5-3-13(4-6-14)20-10-17-18-19-20/h2-8,10H,9H2,1H3
InChIKeyDZEAFLLYYBZONQ-UHFFFAOYSA-N
MW300.29 g/mol
LogP2.39
Rot. Bonds5

About 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole

1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole (PubChem CID 26037458) has the molecular formula C15H13FN4O2 and a molecular weight of 300.29 g/mol. Its IUPAC name is 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole.

Molecular Properties

Compound Name1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole
PubChem CID26037458
Molecular FormulaC15H13FN4O2
Molecular Weight300.29 g/mol
Exact Mass300.10
IUPAC Name1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole
SMILESCOc1ccc(F)cc1COc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H13FN4O2/c1-21-15-7-2-12(16)8-11(15)9-22-14-5-3-13(4-6-14)20-10-17-18-19-20/h2-8,10H,9H2,1H3
InChIKeyDZEAFLLYYBZONQ-UHFFFAOYSA-N
XLogP2.39
TPSA62.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole?
The IUPAC name of 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole (CID 26037458) is 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole.
What is the SMILES notation for 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole?
The canonical SMILES for 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole is COc1ccc(F)cc1COc1ccc(-n2cnnn2)cc1.
What is the InChIKey of 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole?
The InChIKey is DZEAFLLYYBZONQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O2/c1-21-15-7-2-12(16)8-11(15)9-22-14-5-3-13(4-6-14)20-10-17-18-19-20/h2-8,10H,9H2,1H3.
What are the key properties of 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole?
1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole has a molecular weight of 300.29 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]tetrazole is sourced from PubChem (CID 26037458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).