2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol

C15H19N3O2 — CID 133375710

IUPAC2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol
SMILESCCOc1cncc(NCC(O)c2cccc(C)c2)n1
InChIInChI=1S/C15H19N3O2/c1-3-20-15-10-16-9-14(18-15)17-8-13(19)12-6-4-5-11(2)7-12/h4-7,9-10,13,19H,3,8H2,1-2H3,(H,17,18)
InChIKeyXXPQDWKHSNNEOF-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.33
Rot. Bonds6

About 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol

2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol (PubChem CID 133375710) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol.

Molecular Properties

Compound Name2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol
PubChem CID133375710
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol
SMILESCCOc1cncc(NCC(O)c2cccc(C)c2)n1
InChIInChI=1S/C15H19N3O2/c1-3-20-15-10-16-9-14(18-15)17-8-13(19)12-6-4-5-11(2)7-12/h4-7,9-10,13,19H,3,8H2,1-2H3,(H,17,18)
InChIKeyXXPQDWKHSNNEOF-UHFFFAOYSA-N
XLogP2.33
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,4R)-5-[(6-ethoxypyrazin-2-yl)amino]-4-methylpentan-2-ol
CID 124741988
(1R)-1-(3-methylphenyl)-2-[(6-methyl-2-pyridinyl)amino]ethanol
CID 99704551
1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol
CID 133470904
2-[(4-methoxypyrimidin-2-yl)amino]-1-(3-methylphenyl)ethanol
CID 133375715
(1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol
CID 99621227
6-[[2-hydroxy-2-(3-methylphenyl)ethyl]amino]-N-methylpyridine-3-sulfonamide
CID 133375806
(2R)-1-[(6-phenylmethoxypyrazin-2-yl)amino]propan-2-ol
CID 97087587
1-(3-methylphenyl)-2-(propylamino)ethanol
CID 62774312
2-[(6-methoxypyrimidin-4-yl)amino]-1-phenylethanol
CID 45242537
2-[(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)amino]-1-(3-methylphenyl)ethanol
CID 133375786
2-(2-chloroanilino)-1-(3-methylphenyl)ethanol
CID 82044958
2-[(6-methylpyrazin-2-yl)amino]-1-(4-phenylphenyl)ethanol
CID 133477153

Frequently Asked Questions

What is the IUPAC name of 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol?
The IUPAC name of 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol (CID 133375710) is 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol.
What is the SMILES notation for 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol?
The canonical SMILES for 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol is CCOc1cncc(NCC(O)c2cccc(C)c2)n1.
What is the InChIKey of 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol?
The InChIKey is XXPQDWKHSNNEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-3-20-15-10-16-9-14(18-15)17-8-13(19)12-6-4-5-11(2)7-12/h4-7,9-10,13,19H,3,8H2,1-2H3,(H,17,18).
What are the key properties of 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol?
2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol has a molecular weight of 273.34 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol is sourced from PubChem (CID 133375710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).