[3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol

C15H19N3O3 — CID 107745067

IUPAC[3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol
SMILESCCCNc1cncc(Oc2ccc(CO)cc2OC)n1
InChIInChI=1S/C15H19N3O3/c1-3-6-17-14-8-16-9-15(18-14)21-12-5-4-11(10-19)7-13(12)20-2/h4-5,7-9,19H,3,6,10H2,1-2H3,(H,17,18)
InChIKeyVIWMZLIKHZZEJI-UHFFFAOYSA-N
MW289.34 g/mol
LogP2.59
Rot. Bonds7

About [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol

[3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol (PubChem CID 107745067) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol.

Molecular Properties

Compound Name[3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol
PubChem CID107745067
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name[3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol
SMILESCCCNc1cncc(Oc2ccc(CO)cc2OC)n1
InChIInChI=1S/C15H19N3O3/c1-3-6-17-14-8-16-9-15(18-14)21-12-5-4-11(10-19)7-13(12)20-2/h4-5,7-9,19H,3,6,10H2,1-2H3,(H,17,18)
InChIKeyVIWMZLIKHZZEJI-UHFFFAOYSA-N
XLogP2.59
TPSA76.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(2-methoxyphenoxy)-N-propylpyrazin-2-amine
CID 80869118
[4-[6-(hydroxymethyl)pyrazin-2-yl]oxy-3-methoxyphenyl]methanol
CID 107744185
6-(2,6-dimethoxyphenoxy)-N-propylpyrazin-2-amine
CID 80865135
[4-[[6-(ethylamino)-2-pyridinyl]oxy]-3-methoxyphenyl]methanol
CID 107745044
2-[4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]ethanol
CID 107710246
N-butyl-6-(4-ethyl-2-methoxyphenoxy)pyridin-2-amine
CID 24786193
[4-(5,6-dimethylpyrazin-2-yl)oxy-3-methoxyphenyl]methanol
CID 107744072
[4-[2-amino-6-(ethylamino)pyrimidin-4-yl]oxy-3-methoxyphenyl]methanol
CID 107745130
6-(2-ethylphenoxy)-N-propylpyrazin-2-amine
CID 80875740
3-N-[(3,4-dimethoxyphenyl)methyl]-5-N-propyl-1,2,4-triazine-3,5-diamine
CID 112938348
[6-(4-ethyl-2-methoxyphenoxy)pyrazin-2-yl]methanamine
CID 107668249
5-(4-ethyl-2-methoxyphenoxy)-N-propylpyridin-3-amine
CID 107669663

Frequently Asked Questions

What is the IUPAC name of [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol?
The IUPAC name of [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol (CID 107745067) is [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol.
What is the SMILES notation for [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol?
The canonical SMILES for [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol is CCCNc1cncc(Oc2ccc(CO)cc2OC)n1.
What is the InChIKey of [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol?
The InChIKey is VIWMZLIKHZZEJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-3-6-17-14-8-16-9-15(18-14)21-12-5-4-11(10-19)7-13(12)20-2/h4-5,7-9,19H,3,6,10H2,1-2H3,(H,17,18).
What are the key properties of [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol?
[3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol has a molecular weight of 289.34 g/mol, XLogP of 2.59, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methoxy-4-[6-(propylamino)pyrazin-2-yl]oxyphenyl]methanol is sourced from PubChem (CID 107745067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).