1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol

C15H20N2O2 — CID 3133155

IUPAC1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol
SMILESCc1cc(C)n(CC(O)COc2ccccc2C)n1
InChIInChI=1S/C15H20N2O2/c1-11-6-4-5-7-15(11)19-10-14(18)9-17-13(3)8-12(2)16-17/h4-8,14,18H,9-10H2,1-3H3
InChIKeyNEXZNPUYUSCPNB-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.25
Rot. Bonds5

About 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol

1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol (PubChem CID 3133155) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol.

Molecular Properties

Compound Name1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol
PubChem CID3133155
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol
SMILESCc1cc(C)n(CC(O)COc2ccccc2C)n1
InChIInChI=1S/C15H20N2O2/c1-11-6-4-5-7-15(11)19-10-14(18)9-17-13(3)8-12(2)16-17/h4-8,14,18H,9-10H2,1-3H3
InChIKeyNEXZNPUYUSCPNB-UHFFFAOYSA-N
XLogP2.25
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3,5-Dimethyl-pyrazol-1-yl)-3-phenoxy-propan-2-ol
CID 3127806
2-Propanol, 3-(tert-butylamino)-1-(6-(1-(1H-pyrazol-1-yl)vinyl)phenoxy)-
CID 3069766
2-(3-{2-[(4-fluorobenzyl)oxy]phenyl}-1H-pyrazol-1-yl)-1-ethanol
CID 1485523
1-(3,5-Dimethylpyrazolyl)-3-(2-bromophenoxy)propan-2-ol
CID 3844024
N-{4-[2-hydroxy-3-(3,4,5-trimethyl-1H-pyrazol-1-yl)propoxy]phenyl}acetamide
CID 5298752
1-(3,5-dimethylphenoxy)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-ol
CID 22331397
1-(3,5-Dimethylpyrazol-1-yl)-2-(2-methylphenoxy)ethanone
CID 730205
3-[3,5-Diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxybenzonitrile
CID 9921911
2-[4-(2,5-Difluorophenoxy)-3,5-diethyl-pyrazol-1-yl]ethanol
CID 9922209
2-[4-(3,5-Dimethylphenoxy)-3,5-diethyl-pyrazol-1-yl]ethanol
CID 9943816
1-(4-Chlorophenoxy)-3-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methyl-methylamino]propan-2-ol
CID 46927888
1-Benzyloxy-3-(3,5-dimethyl-pyrazol-1-yl)-propan-2-ol
CID 653117

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol?
The IUPAC name of 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol (CID 3133155) is 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol.
What is the SMILES notation for 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol?
The canonical SMILES for 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol is Cc1cc(C)n(CC(O)COc2ccccc2C)n1.
What is the InChIKey of 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol?
The InChIKey is NEXZNPUYUSCPNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11-6-4-5-7-15(11)19-10-14(18)9-17-13(3)8-12(2)16-17/h4-8,14,18H,9-10H2,1-3H3.
What are the key properties of 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol?
1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol has a molecular weight of 260.34 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylpyrazol-1-yl)-3-(2-methylphenoxy)propan-2-ol is sourced from PubChem (CID 3133155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).