1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol

C15H20N2O2 — CID 106790862

IUPAC1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol
SMILESCOc1cc(C)ccc1C(O)CCc1ccnn1C
InChIInChI=1S/C15H20N2O2/c1-11-4-6-13(15(10-11)19-3)14(18)7-5-12-8-9-16-17(12)2/h4,6,8-10,14,18H,5,7H2,1-3H3
InChIKeySXWNNQKDYZJKRF-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.40
Rot. Bonds5

About 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol

1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol (PubChem CID 106790862) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol.

Molecular Properties

Compound Name1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol
PubChem CID106790862
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol
SMILESCOc1cc(C)ccc1C(O)CCc1ccnn1C
InChIInChI=1S/C15H20N2O2/c1-11-4-6-13(15(10-11)19-3)14(18)7-5-12-8-9-16-17(12)2/h4,6,8-10,14,18H,5,7H2,1-3H3
InChIKeySXWNNQKDYZJKRF-UHFFFAOYSA-N
XLogP2.40
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 ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-chloro-3,4-dimethoxyphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol
CID 103006173
1-(2,5-dimethylfuran-3-yl)-3-(2-methylpyrazol-3-yl)propan-1-ol
CID 103027962
1-(2,4-dimethoxyphenyl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030629
3-(2-methylpyrazol-3-yl)-1-(5-methylpyrimidin-2-yl)propan-1-ol
CID 103008459
1-(2,4-dimethylphenyl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030633
3-(2-methylpyrazol-3-yl)-1-naphthalen-1-ylpropan-1-ol
CID 103006025
3-(2-methylpyrazol-3-yl)-1-pyridin-4-ylpropan-1-ol
CID 103005969
5-[2-(2,5-dimethylphenoxy)ethyl]-1-methylpyrazole
CID 103016135
4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol
CID 103008347
1-(3-ethyl-1-methylpyrazol-4-yl)-3-(2-methylpyrazol-3-yl)propan-1-ol
CID 103006766
1-(3,5-dimethylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030528
1-(4-chlorophenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol
CID 103005996

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol?
The IUPAC name of 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol (CID 106790862) is 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol.
What is the SMILES notation for 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol?
The canonical SMILES for 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol is COc1cc(C)ccc1C(O)CCc1ccnn1C.
What is the InChIKey of 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol?
The InChIKey is SXWNNQKDYZJKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-11-4-6-13(15(10-11)19-3)14(18)7-5-12-8-9-16-17(12)2/h4,6,8-10,14,18H,5,7H2,1-3H3.
What are the key properties of 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol?
1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol has a molecular weight of 260.34 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-ol is sourced from PubChem (CID 106790862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).