3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol

C15H20N2O2 — CID 107679807

IUPAC3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol
SMILESCCc1cc(COc2cc(C)cc(O)c2)n(CC)n1
InChIInChI=1S/C15H20N2O2/c1-4-12-8-13(17(5-2)16-12)10-19-15-7-11(3)6-14(18)9-15/h6-9,18H,4-5,10H2,1-3H3
InChIKeyFOPRVUIDZRXABN-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.06
Rot. Bonds5

About 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol

3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol (PubChem CID 107679807) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol.

Molecular Properties

Compound Name3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol
PubChem CID107679807
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol
SMILESCCc1cc(COc2cc(C)cc(O)c2)n(CC)n1
InChIInChI=1S/C15H20N2O2/c1-4-12-8-13(17(5-2)16-12)10-19-15-7-11(3)6-14(18)9-15/h6-9,18H,4-5,10H2,1-3H3
InChIKeyFOPRVUIDZRXABN-UHFFFAOYSA-N
XLogP3.06
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 ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(1,3-diethylpyrazol-5-yl)methoxy]phenyl]ethanol
CID 107709539
2-(chloromethyl)-5-[(1,3-diethylpyrazol-5-yl)methoxy]pyridine
CID 79800563
(1S)-1-[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenyl]ethanamine
CID 79025599
[5-bromo-2-[(1,3-diethylpyrazol-5-yl)methoxy]-3-methylphenyl]methanol
CID 115962171
3-[(1-ethylpyrazol-4-yl)methoxy]-5-methylphenol
CID 107679822
[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol
CID 107698448
2-[2-[(1,3-diethylpyrazol-5-yl)methoxy]phenyl]ethanol
CID 107713078
1,3-diethyl-5-[(2-methyl-5-propan-2-ylphenoxy)methyl]pyrazole
CID 80998222
2-(1,3-diethylpyrazol-5-yl)-1-(3,5-dimethylphenyl)ethanone
CID 115778740
2-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpropane-1,3-diol
CID 79450356
4-chloro-2-[(1,3-diethylpyrazol-5-yl)methoxy]benzenecarboximidamide
CID 114323567
N-[(1,3-diethylpyrazol-5-yl)methyl]-3-fluoro-5-methylaniline
CID 79055004

Frequently Asked Questions

What is the IUPAC name of 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol?
The IUPAC name of 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol (CID 107679807) is 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol.
What is the SMILES notation for 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol?
The canonical SMILES for 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol is CCc1cc(COc2cc(C)cc(O)c2)n(CC)n1.
What is the InChIKey of 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol?
The InChIKey is FOPRVUIDZRXABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-12-8-13(17(5-2)16-12)10-19-15-7-11(3)6-14(18)9-15/h6-9,18H,4-5,10H2,1-3H3.
What are the key properties of 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol?
3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol has a molecular weight of 260.34 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1,3-diethylpyrazol-5-yl)methoxy]-5-methylphenol is sourced from PubChem (CID 107679807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).