[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol

C15H19FN2O2 — CID 107698448

IUPAC[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol
SMILESCCc1cc(COc2ccc(F)cc2CO)n(CC)n1
InChIInChI=1S/C15H19FN2O2/c1-3-13-8-14(18(4-2)17-13)10-20-15-6-5-12(16)7-11(15)9-19/h5-8,19H,3-4,9-10H2,1-2H3
InChIKeyVEFMQAMVUXZREA-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.68
Rot. Bonds6

About [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol

[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol (PubChem CID 107698448) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol.

Molecular Properties

Compound Name[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol
PubChem CID107698448
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC Name[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol
SMILESCCc1cc(COc2ccc(F)cc2CO)n(CC)n1
InChIInChI=1S/C15H19FN2O2/c1-3-13-8-14(18(4-2)17-13)10-20-15-6-5-12(16)7-11(15)9-19/h5-8,19H,3-4,9-10H2,1-2H3
InChIKeyVEFMQAMVUXZREA-UHFFFAOYSA-N
XLogP2.68
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]ethanamine
CID 107700343
2-[2-[(1,3-diethylpyrazol-5-yl)methoxy]phenyl]ethanol
CID 107713078
[2-[(4-chloro-1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol
CID 107698401
[2-[(4-bromo-1-ethyl-3-methylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol
CID 107698635
2-[(1,3-diethylpyrazol-5-yl)methoxy]-6-fluorobenzoic acid
CID 107014090
[5-bromo-2-[(1,3-diethylpyrazol-5-yl)methoxy]-3-methylphenyl]methanol
CID 115962171
2-[4-[(1,3-diethylpyrazol-5-yl)methoxy]phenyl]ethanol
CID 107709539
[2-[(3-ethylimidazol-4-yl)methoxy]-5-fluorophenyl]methanamine
CID 107695029
2-amino-6-[(1,3-diethylpyrazol-5-yl)methoxy]benzoic acid
CID 107341422
[5-fluoro-2-[(4-methylphenyl)methoxy]phenyl]methanol
CID 107698416
[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
CID 107698387
[5-fluoro-2-[(2-methylphenyl)methoxy]phenyl]methanol
CID 107698567

Frequently Asked Questions

What is the IUPAC name of [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol?
The IUPAC name of [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol (CID 107698448) is [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol.
What is the SMILES notation for [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol?
The canonical SMILES for [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol is CCc1cc(COc2ccc(F)cc2CO)n(CC)n1.
What is the InChIKey of [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol?
The InChIKey is VEFMQAMVUXZREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c1-3-13-8-14(18(4-2)17-13)10-20-15-6-5-12(16)7-11(15)9-19/h5-8,19H,3-4,9-10H2,1-2H3.
What are the key properties of [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol?
[2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol has a molecular weight of 278.33 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1,3-diethylpyrazol-5-yl)methoxy]-5-fluorophenyl]methanol is sourced from PubChem (CID 107698448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).