2-methoxy-4-(2-methyltetrazol-5-yl)phenol

C9H10N4O2 — CID 135629809

IUPAC2-methoxy-4-(2-methyltetrazol-5-yl)phenol
SMILESCOc1cc(-c2nnn(C)n2)ccc1O
InChIInChI=1S/C9H10N4O2/c1-13-11-9(10-12-13)6-3-4-7(14)8(5-6)15-2/h3-5,14H,1-2H3
InChIKeyBOAHYZOUJQHYND-UHFFFAOYSA-N
MW206.20 g/mol
LogP0.59
Rot. Bonds2

About 2-methoxy-4-(2-methyltetrazol-5-yl)phenol

2-methoxy-4-(2-methyltetrazol-5-yl)phenol (PubChem CID 135629809) has the molecular formula C9H10N4O2 and a molecular weight of 206.20 g/mol. Its IUPAC name is 2-methoxy-4-(2-methyltetrazol-5-yl)phenol.

Molecular Properties

Compound Name2-methoxy-4-(2-methyltetrazol-5-yl)phenol
PubChem CID135629809
Molecular FormulaC9H10N4O2
Molecular Weight206.20 g/mol
Exact Mass206.08
IUPAC Name2-methoxy-4-(2-methyltetrazol-5-yl)phenol
SMILESCOc1cc(-c2nnn(C)n2)ccc1O
InChIInChI=1S/C9H10N4O2/c1-13-11-9(10-12-13)6-3-4-7(14)8(5-6)15-2/h3-5,14H,1-2H3
InChIKeyBOAHYZOUJQHYND-UHFFFAOYSA-N
XLogP0.59
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(2-methyltetrazol-5-yl)phenol?
The IUPAC name of 2-methoxy-4-(2-methyltetrazol-5-yl)phenol (CID 135629809) is 2-methoxy-4-(2-methyltetrazol-5-yl)phenol.
What is the SMILES notation for 2-methoxy-4-(2-methyltetrazol-5-yl)phenol?
The canonical SMILES for 2-methoxy-4-(2-methyltetrazol-5-yl)phenol is COc1cc(-c2nnn(C)n2)ccc1O.
What is the InChIKey of 2-methoxy-4-(2-methyltetrazol-5-yl)phenol?
The InChIKey is BOAHYZOUJQHYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c1-13-11-9(10-12-13)6-3-4-7(14)8(5-6)15-2/h3-5,14H,1-2H3.
What are the key properties of 2-methoxy-4-(2-methyltetrazol-5-yl)phenol?
2-methoxy-4-(2-methyltetrazol-5-yl)phenol has a molecular weight of 206.20 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(2-methyltetrazol-5-yl)phenol is sourced from PubChem (CID 135629809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).