2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol

C10H14ClN3O — CID 130986944

IUPAC2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol
SMILESOCCC1CCN(c2cnc(Cl)cn2)C1
InChIInChI=1S/C10H14ClN3O/c11-9-5-13-10(6-12-9)14-3-1-8(7-14)2-4-15/h5-6,8,15H,1-4,7H2
InChIKeyWQUQDQWACKDYKS-UHFFFAOYSA-N
MW227.69 g/mol
LogP1.34
Rot. Bonds3

About 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol

2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol (PubChem CID 130986944) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol
PubChem CID130986944
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol
SMILESOCCC1CCN(c2cnc(Cl)cn2)C1
InChIInChI=1S/C10H14ClN3O/c11-9-5-13-10(6-12-9)14-3-1-8(7-14)2-4-15/h5-6,8,15H,1-4,7H2
InChIKeyWQUQDQWACKDYKS-UHFFFAOYSA-N
XLogP1.34
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-(2-hydroxyethyl)pyrrolidin-1-yl]pyrazine-2-carbonitrile
CID 114382889
(3S)-1-(5-chloropyrazin-2-yl)pyrrolidin-3-ol
CID 129416146
(3R)-1-(5-chloropyrazin-2-yl)pyrrolidin-3-ol
CID 129416138
2-[1-(6-chloropyridazin-3-yl)pyrrolidin-3-yl]ethanol
CID 114799166
2-[1-(5-amino-4-methyl-2-pyridinyl)pyrrolidin-3-yl]ethanol
CID 114796912
2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol
CID 77059115
2-[1-(2-amino-5-chloropyrimidin-4-yl)pyrrolidin-3-yl]ethanol
CID 114802870
[3-(5-chloropyrazin-2-yl)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
CID 163209145
2-[1-(4-chlorophenyl)pyrrolidin-3-yl]ethanol
CID 83981447
2-[1-(6-chloro-2-phenylpyrimidin-4-yl)pyrrolidin-3-yl]ethanol
CID 114799174
6-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
CID 115658002
5-chloro-2-[3-(2-hydroxyethyl)piperidin-1-yl]pyridine-4-carboxylic acid
CID 107227689

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol?
The IUPAC name of 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol (CID 130986944) is 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol?
The canonical SMILES for 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol is OCCC1CCN(c2cnc(Cl)cn2)C1.
What is the InChIKey of 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol?
The InChIKey is WQUQDQWACKDYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c11-9-5-13-10(6-12-9)14-3-1-8(7-14)2-4-15/h5-6,8,15H,1-4,7H2.
What are the key properties of 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol?
2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol has a molecular weight of 227.69 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol is sourced from PubChem (CID 130986944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).