5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol

C13H16N2O2 — CID 105491179

IUPAC5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol
SMILESCOc1ccc(-c2c(O)cnn2C(C)C)cc1
InChIInChI=1S/C13H16N2O2/c1-9(2)15-13(12(16)8-14-15)10-4-6-11(17-3)7-5-10/h4-9,16H,1-3H3
InChIKeyKROHUVNYILGHHM-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.85
Rot. Bonds3

About 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol

5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol (PubChem CID 105491179) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol
PubChem CID105491179
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol
SMILESCOc1ccc(-c2c(O)cnn2C(C)C)cc1
InChIInChI=1S/C13H16N2O2/c1-9(2)15-13(12(16)8-14-15)10-4-6-11(17-3)7-5-10/h4-9,16H,1-3H3
InChIKeyKROHUVNYILGHHM-UHFFFAOYSA-N
XLogP2.85
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-bromo-1-(difluoromethyl)-5-(4-methoxyphenyl)pyrazole
CID 171075985
(4-methoxyphenyl)-(4-methoxy-1-propan-2-ylpyrazol-5-yl)methanol
CID 114634045
6-(4-methoxyphenyl)pyridin-3-ol
CID 53229210
1-[5-(4-methoxyphenyl)-1-methylpyrazol-4-yl]ethanamine
CID 105489932
1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine
CID 105471347
4,5-bis(4-methoxyphenyl)-1-propan-2-ylimidazole
CID 14278147
ethane;4-(4-methoxyphenyl)phenol
CID 161219857
4-(1-propan-2-ylindazol-5-yl)oxyphenol
CID 22349445
1-[4-(4-methoxyphenyl)-1-methylpyrazol-5-yl]ethanamine
CID 105423470
5-(4-methoxyphenyl)-3-propan-2-yltriazol-4-amine
CID 105491202
5-(4-methoxyphenyl)-1-methylpyrazol-4-amine
CID 28803590
(4-methoxyphenyl)silane
CID 100998160

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol?
The IUPAC name of 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol (CID 105491179) is 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol.
What is the SMILES notation for 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol?
The canonical SMILES for 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol is COc1ccc(-c2c(O)cnn2C(C)C)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol?
The InChIKey is KROHUVNYILGHHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-9(2)15-13(12(16)8-14-15)10-4-6-11(17-3)7-5-10/h4-9,16H,1-3H3.
What are the key properties of 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol?
5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol has a molecular weight of 232.28 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-1-propan-2-ylpyrazol-4-ol is sourced from PubChem (CID 105491179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).