1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol

C14H17N3O2 — CID 133470904

IUPAC1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol
SMILESCOc1cccc(C(O)CNc2cncc(C)n2)c1
InChIInChI=1S/C14H17N3O2/c1-10-7-15-9-14(17-10)16-8-13(18)11-4-3-5-12(6-11)19-2/h3-7,9,13,18H,8H2,1-2H3,(H,16,17)
InChIKeyNWDVJBWQYBTXHG-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.94
Rot. Bonds5

About 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol

1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol (PubChem CID 133470904) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol
PubChem CID133470904
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol
SMILESCOc1cccc(C(O)CNc2cncc(C)n2)c1
InChIInChI=1S/C14H17N3O2/c1-10-7-15-9-14(17-10)16-8-13(18)11-4-3-5-12(6-11)19-2/h3-7,9,13,18H,8H2,1-2H3,(H,16,17)
InChIKeyNWDVJBWQYBTXHG-UHFFFAOYSA-N
XLogP1.94
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-methylpyrazin-2-yl)amino]-1-(4-phenylphenyl)ethanol
CID 133477153
1-(4-tert-butylphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol
CID 133471375
2-(4-methoxy-3-methylanilino)-1-(3-methoxyphenyl)ethanol
CID 81134083
1-(3-methoxyphenyl)-2-[(2,3,5,6-tetrafluoro-4-pyridinyl)amino]ethanol
CID 133372605
2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol
CID 133375710
(1S)-1-(furan-2-yl)-2-[(6-methylpyrazin-2-yl)amino]ethanol
CID 97351936
2-(4-iodoanilino)-1-(3-methoxyphenyl)ethanol
CID 81134599
2-(3-bromo-5-methylanilino)-1-(3-methoxyphenyl)ethanol
CID 107583297
1-(3-methoxyphenyl)-2-[(4-methyl-3-pyridinyl)methylamino]ethanol
CID 114955555
(1R)-1-(3-methylphenyl)-2-[(6-methyl-2-pyridinyl)amino]ethanol
CID 99704551
2-[6-[[2-hydroxy-2-(3-methoxyphenyl)ethyl]amino]-3-pyridinyl]-4,5-dimethyl-1H-pyrimidin-6-one
CID 137275396
2-(5-bromo-2-methylanilino)-1-(3-methoxyphenyl)ethanol
CID 81135103

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol?
The IUPAC name of 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol (CID 133470904) is 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol.
What is the SMILES notation for 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol?
The canonical SMILES for 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol is COc1cccc(C(O)CNc2cncc(C)n2)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol?
The InChIKey is NWDVJBWQYBTXHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10-7-15-9-14(17-10)16-8-13(18)11-4-3-5-12(6-11)19-2/h3-7,9,13,18H,8H2,1-2H3,(H,16,17).
What are the key properties of 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol?
1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol has a molecular weight of 259.31 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol is sourced from PubChem (CID 133470904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).