2-methoxy-6-(1-methylpyrazol-4-yl)phenol

C11H12N2O2 — CID 83130518

IUPAC2-methoxy-6-(1-methylpyrazol-4-yl)phenol
SMILESCOc1cccc(-c2cnn(C)c2)c1O
InChIInChI=1S/C11H12N2O2/c1-13-7-8(6-12-13)9-4-3-5-10(15-2)11(9)14/h3-7,14H,1-2H3
InChIKeyQQQHJJIBOQRBER-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.80
Rot. Bonds2

About 2-methoxy-6-(1-methylpyrazol-4-yl)phenol

2-methoxy-6-(1-methylpyrazol-4-yl)phenol (PubChem CID 83130518) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-methoxy-6-(1-methylpyrazol-4-yl)phenol.

Molecular Properties

Compound Name2-methoxy-6-(1-methylpyrazol-4-yl)phenol
PubChem CID83130518
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name2-methoxy-6-(1-methylpyrazol-4-yl)phenol
SMILESCOc1cccc(-c2cnn(C)c2)c1O
InChIInChI=1S/C11H12N2O2/c1-13-7-8(6-12-13)9-4-3-5-10(15-2)11(9)14/h3-7,14H,1-2H3
InChIKeyQQQHJJIBOQRBER-UHFFFAOYSA-N
XLogP1.80
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(1-methylpyrazol-4-yl)phenol?
The IUPAC name of 2-methoxy-6-(1-methylpyrazol-4-yl)phenol (CID 83130518) is 2-methoxy-6-(1-methylpyrazol-4-yl)phenol.
What is the SMILES notation for 2-methoxy-6-(1-methylpyrazol-4-yl)phenol?
The canonical SMILES for 2-methoxy-6-(1-methylpyrazol-4-yl)phenol is COc1cccc(-c2cnn(C)c2)c1O.
What is the InChIKey of 2-methoxy-6-(1-methylpyrazol-4-yl)phenol?
The InChIKey is QQQHJJIBOQRBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-13-7-8(6-12-13)9-4-3-5-10(15-2)11(9)14/h3-7,14H,1-2H3.
What are the key properties of 2-methoxy-6-(1-methylpyrazol-4-yl)phenol?
2-methoxy-6-(1-methylpyrazol-4-yl)phenol has a molecular weight of 204.23 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(1-methylpyrazol-4-yl)phenol is sourced from PubChem (CID 83130518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).