2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol

C10H17N3O — CID 105449213

IUPAC2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol
SMILESCN1CCC(n2cc(CCO)cn2)C1
InChIInChI=1S/C10H17N3O/c1-12-4-2-10(8-12)13-7-9(3-5-14)6-11-13/h6-7,10,14H,2-5,8H2,1H3
InChIKeyDGBXLIZAJNWCCL-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.29
Rot. Bonds3

About 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol

2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol (PubChem CID 105449213) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol.

Molecular Properties

Compound Name2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol
PubChem CID105449213
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol
SMILESCN1CCC(n2cc(CCO)cn2)C1
InChIInChI=1S/C10H17N3O/c1-12-4-2-10(8-12)13-7-9(3-5-14)6-11-13/h6-7,10,14H,2-5,8H2,1H3
InChIKeyDGBXLIZAJNWCCL-UHFFFAOYSA-N
XLogP0.29
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-1-(1-methylpyrrolidin-3-yl)pyrazole
CID 70661033
2-(1-piperidin-4-ylpyrazol-4-yl)ethanol
CID 105449212
2-(1-methylpyrazol-4-yl)ethanol
CID 17028076
2-[1-(thian-3-yl)pyrazol-4-yl]ethanol
CID 105466272
2-[1-(1-methylazetidin-3-yl)pyrazol-4-yl]acetic acid
CID 84733244
1-(1-methylpiperidin-4-yl)pyrazole-4-thiol
CID 149139949
1-(1-methylpyrrolidin-3-yl)-4-pyrrolidin-3-ylpyrazole
CID 105476564
1-[4-[4-[4-(2-hydroxyethyl)phenyl]pyrazol-1-yl]piperidin-1-yl]ethanone
CID 166637826
2-[1-(1-ethylpyrrolidin-3-yl)pyrazol-4-yl]acetic acid
CID 105480595
3-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]piperidine
CID 105495229
1-methyl-4-[(1-methylpyrazol-4-yl)methyl]piperidine
CID 121407190
4-(4-bromopyrazol-1-yl)-1-methylpiperidine
CID 59599418

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol?
The IUPAC name of 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol (CID 105449213) is 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol.
What is the SMILES notation for 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol?
The canonical SMILES for 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol is CN1CCC(n2cc(CCO)cn2)C1.
What is the InChIKey of 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol?
The InChIKey is DGBXLIZAJNWCCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-12-4-2-10(8-12)13-7-9(3-5-14)6-11-13/h6-7,10,14H,2-5,8H2,1H3.
What are the key properties of 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol?
2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol has a molecular weight of 195.27 g/mol, XLogP of 0.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol is sourced from PubChem (CID 105449213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).