1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole

C15H14N4O2 — CID 864333

IUPAC1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole
SMILESCOc1ccc(-c2nnnn2-c2ccccc2OC)cc1
InChIInChI=1S/C15H14N4O2/c1-20-12-9-7-11(8-10-12)15-16-17-18-19(15)13-5-3-4-6-14(13)21-2/h3-10H,1-2H3
InChIKeyRVPBSHYEMHOHLI-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.35
Rot. Bonds4

About 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole

1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole (PubChem CID 864333) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole
PubChem CID864333
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole
SMILESCOc1ccc(-c2nnnn2-c2ccccc2OC)cc1
InChIInChI=1S/C15H14N4O2/c1-20-12-9-7-11(8-10-12)15-16-17-18-19(15)13-5-3-4-6-14(13)21-2/h3-10H,1-2H3
InChIKeyRVPBSHYEMHOHLI-UHFFFAOYSA-N
XLogP2.35
TPSA62.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole?
The IUPAC name of 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole (CID 864333) is 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole.
What is the SMILES notation for 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole?
The canonical SMILES for 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole is COc1ccc(-c2nnnn2-c2ccccc2OC)cc1.
What is the InChIKey of 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole?
The InChIKey is RVPBSHYEMHOHLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-20-12-9-7-11(8-10-12)15-16-17-18-19(15)13-5-3-4-6-14(13)21-2/h3-10H,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole?
1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole has a molecular weight of 282.30 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-5-(4-methoxyphenyl)tetrazole is sourced from PubChem (CID 864333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).