5-(3-methoxyphenyl)-1-methylpyrazol-4-ol

C11H12N2O2 — CID 105456123

IUPAC5-(3-methoxyphenyl)-1-methylpyrazol-4-ol
SMILESCOc1cccc(-c2c(O)cnn2C)c1
InChIInChI=1S/C11H12N2O2/c1-13-11(10(14)7-12-13)8-4-3-5-9(6-8)15-2/h3-7,14H,1-2H3
InChIKeyGQXSTRGGOSXUJW-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.80
Rot. Bonds2

About 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol

5-(3-methoxyphenyl)-1-methylpyrazol-4-ol (PubChem CID 105456123) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol.

Molecular Properties

Compound Name5-(3-methoxyphenyl)-1-methylpyrazol-4-ol
PubChem CID105456123
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name5-(3-methoxyphenyl)-1-methylpyrazol-4-ol
SMILESCOc1cccc(-c2c(O)cnn2C)c1
InChIInChI=1S/C11H12N2O2/c1-13-11(10(14)7-12-13)8-4-3-5-9(6-8)15-2/h3-7,14H,1-2H3
InChIKeyGQXSTRGGOSXUJW-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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Related Compounds

5-(3-methoxyphenyl)-1-methylpyrazole-4-carbaldehyde
CID 83821629
5-(3-methoxyphenyl)-1,3-dimethylpyrazole
CID 57246578
[1-ethyl-5-(3-methoxyphenyl)pyrazol-4-yl]methanamine
CID 105489897
5-(3-methoxyphenyl)-1-methyltriazole-4-carboxylic acid
CID 82207563
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-[5-(3-methoxyphenyl)-1-methylpyrazol-4-yl]methanone
CID 58724566
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
2-(3-methoxyphenyl)benzene-1,4-diol
CID 83534427
3-(chloromethyl)-5-(3-methoxyphenyl)-1-methylpyrazole
CID 82129617
[5-(3-methoxyphenyl)-1-methyltriazol-4-yl]methanamine
CID 82207885
[5-(3-methoxyphenyl)-1-methylpyrazol-3-yl]methanethiol
CID 82159157
3,4,4a,5,6,7-hexahydro-2H-quinolin-1-yl-[5-(3-methoxyphenyl)-1-methylpyrazol-4-yl]methanone
CID 67360999

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol?
The IUPAC name of 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol (CID 105456123) is 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol.
What is the SMILES notation for 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol?
The canonical SMILES for 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol is COc1cccc(-c2c(O)cnn2C)c1.
What is the InChIKey of 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol?
The InChIKey is GQXSTRGGOSXUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-13-11(10(14)7-12-13)8-4-3-5-9(6-8)15-2/h3-7,14H,1-2H3.
What are the key properties of 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol?
5-(3-methoxyphenyl)-1-methylpyrazol-4-ol 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 5-(3-methoxyphenyl)-1-methylpyrazol-4-ol is sourced from PubChem (CID 105456123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).