[4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol

C15H20N2O4 — CID 62125678

IUPAC[4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol
SMILESCCn1cc(COc2c(OC)cc(CO)cc2OC)cn1
InChIInChI=1S/C15H20N2O4/c1-4-17-8-12(7-16-17)10-21-15-13(19-2)5-11(9-18)6-14(15)20-3/h5-8,18H,4,9-10H2,1-3H3
InChIKeyZELVHIDPJWOARS-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.99
Rot. Bonds7

About [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol

[4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol (PubChem CID 62125678) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol.

Molecular Properties

Compound Name[4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol
PubChem CID62125678
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name[4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol
SMILESCCn1cc(COc2c(OC)cc(CO)cc2OC)cn1
InChIInChI=1S/C15H20N2O4/c1-4-17-8-12(7-16-17)10-21-15-13(19-2)5-11(9-18)6-14(15)20-3/h5-8,18H,4,9-10H2,1-3H3
InChIKeyZELVHIDPJWOARS-UHFFFAOYSA-N
XLogP1.99
TPSA65.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol?
The IUPAC name of [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol (CID 62125678) is [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol.
What is the SMILES notation for [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol?
The canonical SMILES for [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol is CCn1cc(COc2c(OC)cc(CO)cc2OC)cn1.
What is the InChIKey of [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol?
The InChIKey is ZELVHIDPJWOARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-4-17-8-12(7-16-17)10-21-15-13(19-2)5-11(9-18)6-14(15)20-3/h5-8,18H,4,9-10H2,1-3H3.
What are the key properties of [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol?
[4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol has a molecular weight of 292.34 g/mol, XLogP of 1.99, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(1-ethylpyrazol-4-yl)methoxy]-3,5-dimethoxyphenyl]methanol is sourced from PubChem (CID 62125678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).