2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol

C11H19N3O — CID 105463332

IUPAC2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol
SMILESCc1c(CCO)cnn1C1CCCN1C
InChIInChI=1S/C11H19N3O/c1-9-10(5-7-15)8-12-14(9)11-4-3-6-13(11)2/h8,11,15H,3-7H2,1-2H3
InChIKeyDGQQTGWPFMFIQV-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.95
Rot. Bonds3

About 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol

2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol (PubChem CID 105463332) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol.

Molecular Properties

Compound Name2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol
PubChem CID105463332
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol
SMILESCc1c(CCO)cnn1C1CCCN1C
InChIInChI=1S/C11H19N3O/c1-9-10(5-7-15)8-12-14(9)11-4-3-6-13(11)2/h8,11,15H,3-7H2,1-2H3
InChIKeyDGQQTGWPFMFIQV-UHFFFAOYSA-N
XLogP0.95
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol?
The IUPAC name of 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol (CID 105463332) is 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol.
What is the SMILES notation for 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol?
The canonical SMILES for 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol is Cc1c(CCO)cnn1C1CCCN1C.
What is the InChIKey of 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol?
The InChIKey is DGQQTGWPFMFIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-10(5-7-15)8-12-14(9)11-4-3-6-13(11)2/h8,11,15H,3-7H2,1-2H3.
What are the key properties of 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol?
2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol has a molecular weight of 209.29 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-1-(1-methylpyrrolidin-2-yl)pyrazol-4-yl]ethanol is sourced from PubChem (CID 105463332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).