4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole

C11H10F2N2O — CID 116794247

IUPAC4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole
SMILESCn1cc(OCc2ccc(F)cc2F)cn1
InChIInChI=1S/C11H10F2N2O/c1-15-6-10(5-14-15)16-7-8-2-3-9(12)4-11(8)13/h2-6H,7H2,1H3
InChIKeyCHAUHYDURQDRKE-UHFFFAOYSA-N
MW224.21 g/mol
LogP2.28
Rot. Bonds3

About 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole

4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole (PubChem CID 116794247) has the molecular formula C11H10F2N2O and a molecular weight of 224.21 g/mol. Its IUPAC name is 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole.

Molecular Properties

Compound Name4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole
PubChem CID116794247
Molecular FormulaC11H10F2N2O
Molecular Weight224.21 g/mol
Exact Mass224.08
IUPAC Name4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole
SMILESCn1cc(OCc2ccc(F)cc2F)cn1
InChIInChI=1S/C11H10F2N2O/c1-15-6-10(5-14-15)16-7-8-2-3-9(12)4-11(8)13/h2-6H,7H2,1H3
InChIKeyCHAUHYDURQDRKE-UHFFFAOYSA-N
XLogP2.28
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.21
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-difluoro-1-[(4-fluorophenoxy)methyl]benzene
CID 64765828
4-[(2-methoxyphenyl)methoxy]-1-methylpyrazole
CID 116794197
N-[[4-fluoro-3-[(1-methylpyrazol-4-yl)oxymethyl]phenyl]methyl]ethanamine
CID 107457958
N-[[4-fluoro-3-[(1-methylpyrazol-4-yl)oxymethyl]phenyl]methyl]propan-1-amine
CID 107457959
[3-fluoro-5-[(1-methylpyrazol-4-yl)oxymethyl]phenyl]methanamine
CID 116792491
3-(2,6-dichlorophenyl)-6-[(2,4-difluorophenyl)methoxy]-1-methylpyrazolo[1,5-a]pyrimidin-2-one
CID 71217890
1-[(4-bromophenoxy)methyl]-2,4-difluorobenzene
CID 63531797
1-methyl-4-phenylmethoxypyrazole
CID 84661432
1-[(2,4-difluorophenyl)methyl]-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine
CID 121339192
2-[(1-methylpyrazol-4-yl)oxymethyl]benzonitrile
CID 115753079
3-chloro-4-[(1-methylpyrazol-4-yl)oxymethyl]pyridine
CID 116794133
4-[(4-bromo-2-nitrophenyl)methoxy]-1-methylpyrazole
CID 114382709

Frequently Asked Questions

What is the IUPAC name of 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole?
The IUPAC name of 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole (CID 116794247) is 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole.
What is the SMILES notation for 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole?
The canonical SMILES for 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole is Cn1cc(OCc2ccc(F)cc2F)cn1.
What is the InChIKey of 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole?
The InChIKey is CHAUHYDURQDRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2O/c1-15-6-10(5-14-15)16-7-8-2-3-9(12)4-11(8)13/h2-6H,7H2,1H3.
What are the key properties of 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole?
4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole has a molecular weight of 224.21 g/mol, XLogP of 2.28, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,4-difluorophenyl)methoxy]-1-methylpyrazole is sourced from PubChem (CID 116794247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).