(1R)-2-chloro-1-pyrazin-2-ylethanol

C6H7ClN2O — CID 55298108

IUPAC(1R)-2-chloro-1-pyrazin-2-ylethanol
SMILESO[C@@H](CCl)c1cnccn1
InChIInChI=1S/C6H7ClN2O/c7-3-6(10)5-4-8-1-2-9-5/h1-2,4,6,10H,3H2/t6-/m0/s1
InChIKeyUUDOAGGITCXZJP-LURJTMIESA-N
MW158.59 g/mol
LogP0.75
Rot. Bonds2

About (1R)-2-chloro-1-pyrazin-2-ylethanol

(1R)-2-chloro-1-pyrazin-2-ylethanol (PubChem CID 55298108) has the molecular formula C6H7ClN2O and a molecular weight of 158.59 g/mol. Its IUPAC name is (1R)-2-chloro-1-pyrazin-2-ylethanol.

Molecular Properties

Compound Name(1R)-2-chloro-1-pyrazin-2-ylethanol
PubChem CID55298108
Molecular FormulaC6H7ClN2O
Molecular Weight158.59 g/mol
Exact Mass158.02
IUPAC Name(1R)-2-chloro-1-pyrazin-2-ylethanol
SMILESO[C@@H](CCl)c1cnccn1
InChIInChI=1S/C6H7ClN2O/c7-3-6(10)5-4-8-1-2-9-5/h1-2,4,6,10H,3H2/t6-/m0/s1
InChIKeyUUDOAGGITCXZJP-LURJTMIESA-N
XLogP0.75
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.59
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol
CID 96734232
(1S)-2-(methylamino)-1-pyrazin-2-ylethanol
CID 96734230
4-pyrazin-2-ylbutane-1,1,1,4-tetrol
CID 87881315
3-methoxy-1-pyrazin-2-ylpropan-1-ol
CID 62608017
(1S)-2-azido-1-pyrazin-2-ylethanol
CID 83092675
3-methylsulfonyl-1-pyrazin-2-ylpropan-1-ol
CID 62605954
3-propan-2-yloxy-1-pyrazin-2-ylpropan-1-ol
CID 114997368
3-(3-methylbutoxy)-1-pyrazin-2-ylpropan-1-ol
CID 115001589
1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol
CID 20641667
2-chloro-1-pyridin-2-ylethanol
CID 22145518
3-bromo-1-pyrazin-2-ylpropane-1,2-diol
CID 171859387
2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol
CID 79752608

Frequently Asked Questions

What is the IUPAC name of (1R)-2-chloro-1-pyrazin-2-ylethanol?
The IUPAC name of (1R)-2-chloro-1-pyrazin-2-ylethanol (CID 55298108) is (1R)-2-chloro-1-pyrazin-2-ylethanol.
What is the SMILES notation for (1R)-2-chloro-1-pyrazin-2-ylethanol?
The canonical SMILES for (1R)-2-chloro-1-pyrazin-2-ylethanol is O[C@@H](CCl)c1cnccn1.
What is the InChIKey of (1R)-2-chloro-1-pyrazin-2-ylethanol?
The InChIKey is UUDOAGGITCXZJP-LURJTMIESA-N. The full InChI is InChI=1S/C6H7ClN2O/c7-3-6(10)5-4-8-1-2-9-5/h1-2,4,6,10H,3H2/t6-/m0/s1.
What are the key properties of (1R)-2-chloro-1-pyrazin-2-ylethanol?
(1R)-2-chloro-1-pyrazin-2-ylethanol has a molecular weight of 158.59 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-chloro-1-pyrazin-2-ylethanol is sourced from PubChem (CID 55298108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).