2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol

C14H18N2O2 — CID 82527913

IUPAC2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol
SMILESCOc1ccc(-n2ncc(C(C)(C)O)c2C)cc1
InChIInChI=1S/C14H18N2O2/c1-10-13(14(2,3)17)9-15-16(10)11-5-7-12(18-4)8-6-11/h5-9,17H,1-4H3
InChIKeyQICSFONMAFGDSY-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.42
Rot. Bonds3

About 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol

2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol (PubChem CID 82527913) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol.

Molecular Properties

Compound Name2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol
PubChem CID82527913
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol
SMILESCOc1ccc(-n2ncc(C(C)(C)O)c2C)cc1
InChIInChI=1S/C14H18N2O2/c1-10-13(14(2,3)17)9-15-16(10)11-5-7-12(18-4)8-6-11/h5-9,17H,1-4H3
InChIKeyQICSFONMAFGDSY-UHFFFAOYSA-N
XLogP2.42
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(3,4-dichlorophenyl)-5-methylpyrazol-4-yl]propan-2-ol
CID 82528206
2-[1-(3-chloro-4-methylphenyl)-5-methylpyrazol-4-yl]propan-2-ol
CID 82528117
2-[1-(3,5-dichlorophenyl)-5-methylpyrazol-4-yl]propan-2-ol
CID 82528188
2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]ethanol
CID 105490895
1-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]ethane-1,2-diamine
CID 170894623
4-(4-methoxyphenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole
CID 174394516
2-[1-(2,4-dimethylphenyl)-5-methylpyrazol-4-yl]propan-2-ol
CID 82528554
2-amino-3-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-1-ol;hydrochloride
CID 170892802
1-[1-(4-methoxyphenyl)indazol-5-yl]-2-naphthalen-1-ylpropan-2-ol
CID 143371944
(1S)-1-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 25277206
1-[5-methyl-1-[4-(trifluoromethoxy)phenyl]pyrazol-4-yl]ethanol
CID 66489417
4-methoxy-1-(4-methoxyphenyl)pyrazole-5-carboxylic acid
CID 117233112

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol?
The IUPAC name of 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol (CID 82527913) is 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol.
What is the SMILES notation for 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol?
The canonical SMILES for 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol is COc1ccc(-n2ncc(C(C)(C)O)c2C)cc1.
What is the InChIKey of 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol?
The InChIKey is QICSFONMAFGDSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-10-13(14(2,3)17)9-15-16(10)11-5-7-12(18-4)8-6-11/h5-9,17H,1-4H3.
What are the key properties of 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol?
2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol has a molecular weight of 246.31 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]propan-2-ol is sourced from PubChem (CID 82527913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).