1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol

C11H18N2O3 — CID 114637080

IUPAC1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol
SMILESCOCC(O)(c1c(OC)cnn1C)C1CC1
InChIInChI=1S/C11H18N2O3/c1-13-10(9(16-3)6-12-13)11(14,7-15-2)8-4-5-8/h6,8,14H,4-5,7H2,1-3H3
InChIKeyYIYCOPHIPPFURG-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.67
Rot. Bonds5

About 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol

1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol (PubChem CID 114637080) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol
PubChem CID114637080
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol
SMILESCOCC(O)(c1c(OC)cnn1C)C1CC1
InChIInChI=1S/C11H18N2O3/c1-13-10(9(16-3)6-12-13)11(14,7-15-2)8-4-5-8/h6,8,14H,4-5,7H2,1-3H3
InChIKeyYIYCOPHIPPFURG-UHFFFAOYSA-N
XLogP0.67
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopropyl-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol
CID 114636126
1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol
CID 114633612
2-(4-methoxy-1-methylpyrazol-5-yl)-3-methylbutan-2-ol
CID 114633592
2-hydroxy-2-(4-methoxy-1-methylpyrazol-5-yl)propanal
CID 114636624
1,1-dimethoxy-2-(4-methoxy-1-methylpyrazol-5-yl)propan-2-ol
CID 114636611
4,4-dimethoxy-2-(4-methoxy-1-methylpyrazol-5-yl)butan-2-ol
CID 114636581
4-[1-hydroxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]benzonitrile
CID 114637601
2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol
CID 114633553
2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol
CID 114643178
2-(4-methoxy-1-methylpyrazol-5-yl)-5-(trifluoromethyl)piperidine
CID 106781309
3-(4-methoxy-1-methylpyrazol-5-yl)oxy-2,2-dimethylpropan-1-ol
CID 114637264
3-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)-3-methylbutan-1-ol
CID 103027713

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol?
The IUPAC name of 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol (CID 114637080) is 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol?
The canonical SMILES for 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol is COCC(O)(c1c(OC)cnn1C)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol?
The InChIKey is YIYCOPHIPPFURG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c1-13-10(9(16-3)6-12-13)11(14,7-15-2)8-4-5-8/h6,8,14H,4-5,7H2,1-3H3.
What are the key properties of 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol?
1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol has a molecular weight of 226.28 g/mol, XLogP of 0.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanol is sourced from PubChem (CID 114637080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).