1-(5-chloro-6-ethylpyrazin-2-yl)ethanol

C8H11ClN2O — CID 162520398

IUPAC1-(5-chloro-6-ethylpyrazin-2-yl)ethanol
SMILESCCc1nc(C(C)O)cnc1Cl
InChIInChI=1S/C8H11ClN2O/c1-3-6-8(9)10-4-7(11-6)5(2)12/h4-5,12H,3H2,1-2H3
InChIKeyWOPLKUHGZZKWMK-UHFFFAOYSA-N
MW186.64 g/mol
LogP1.75
Rot. Bonds2

About 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol

1-(5-chloro-6-ethylpyrazin-2-yl)ethanol (PubChem CID 162520398) has the molecular formula C8H11ClN2O and a molecular weight of 186.64 g/mol. Its IUPAC name is 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-chloro-6-ethylpyrazin-2-yl)ethanol
PubChem CID162520398
Molecular FormulaC8H11ClN2O
Molecular Weight186.64 g/mol
Exact Mass186.06
IUPAC Name1-(5-chloro-6-ethylpyrazin-2-yl)ethanol
SMILESCCc1nc(C(C)O)cnc1Cl
InChIInChI=1S/C8H11ClN2O/c1-3-6-8(9)10-4-7(11-6)5(2)12/h4-5,12H,3H2,1-2H3
InChIKeyWOPLKUHGZZKWMK-UHFFFAOYSA-N
XLogP1.75
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.64
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chloro-4-ethylpyrimidin-5-yl)ethanol
CID 177012608
5-butan-2-yl-3-ethyl-2-methylpyrazine
CID 55254891
(1R)-1-(5-chloro-2-pyridinyl)ethanol
CID 75356463
(1R)-1-(2-chloropyrimidin-4-yl)ethanol
CID 124566529
1-(1H-pyrazolo[3,4-b]pyrazin-5-yl)ethanol
CID 44829120
ethane;2-ethyl-4-propan-2-ylpyrimidine;sulfanol
CID 165133315
ethane;2-ethyl-4-propan-2-ylpyrimidine
CID 154681512
4-ethyl-6-propan-2-ylpyrido[3,2-d]pyrimidine
CID 163292345
6-(difluoromethyl)-3-ethylpyrazin-2-amine
CID 162562681
3-chloro-2-ethyl-5-propan-2-ylpyridine;ethane
CID 142611311
(1S)-1-(4-ethyl-2-methylpyrimidin-5-yl)propan-1-ol
CID 130927837
2-chloro-3-(difluoromethyl)-5-ethylpyridine
CID 105445604

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol?
The IUPAC name of 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol (CID 162520398) is 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol.
What is the SMILES notation for 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol?
The canonical SMILES for 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol is CCc1nc(C(C)O)cnc1Cl.
What is the InChIKey of 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol?
The InChIKey is WOPLKUHGZZKWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2O/c1-3-6-8(9)10-4-7(11-6)5(2)12/h4-5,12H,3H2,1-2H3.
What are the key properties of 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol?
1-(5-chloro-6-ethylpyrazin-2-yl)ethanol has a molecular weight of 186.64 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-6-ethylpyrazin-2-yl)ethanol is sourced from PubChem (CID 162520398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).