2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol

C19H20N2O3 — CID 91161860

IUPAC2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol
SMILESCC(C)Oc1ccc(Oc2cnc3cc(CCO)ccc3n2)cc1
InChIInChI=1S/C19H20N2O3/c1-13(2)23-15-4-6-16(7-5-15)24-19-12-20-18-11-14(9-10-22)3-8-17(18)21-19/h3-8,11-13,22H,9-10H2,1-2H3
InChIKeyJDUWLDXBPMMHEK-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.74
Rot. Bonds6

About 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol

2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol (PubChem CID 91161860) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol.

Molecular Properties

Compound Name2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol
PubChem CID91161860
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol
SMILESCC(C)Oc1ccc(Oc2cnc3cc(CCO)ccc3n2)cc1
InChIInChI=1S/C19H20N2O3/c1-13(2)23-15-4-6-16(7-5-15)24-19-12-20-18-11-14(9-10-22)3-8-17(18)21-19/h3-8,11-13,22H,9-10H2,1-2H3
InChIKeyJDUWLDXBPMMHEK-UHFFFAOYSA-N
XLogP3.74
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-quinoxalin-2-yloxyphenyl)methanol
CID 79868894
2-[4-[6-(trifluoromethyl)quinoxalin-2-yl]oxyphenoxy]propanoic acid chloride
CID 86740146
2-[4-(6-amino-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]ethanol
CID 107710217
2-[4-(7-methoxyquinoxalin-2-yl)oxyphenoxy]propanoic acid
CID 10807054
(2R)-2-[4-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanoic acid
CID 3246729
2-[4-[[4-(1-aminoethyl)-2-pyridinyl]oxy]phenyl]ethanol
CID 107709110
copper;3-(4-propan-2-yloxyphenyl)propan-1-ol
CID 70633990
N-(2-hydroxyethyl)-N-[1-[2-(4-propan-2-yloxyphenoxy)quinolin-6-yl]ethyl]formamide
CID 91297098
methyl 2-[4-(7-aminoquinoxalin-2-yl)oxyphenoxy]propanoate
CID 10830920
ethyl 2-[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoyloxy]-3-methylbut-3-enoate
CID 57418245
2-(4-quinoxalin-2-yloxyphenyl)ethanamine
CID 62360984
2-[4-[(4-methyl-2-pyridinyl)oxy]phenyl]ethanol
CID 107709611

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol?
The IUPAC name of 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol (CID 91161860) is 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol.
What is the SMILES notation for 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol?
The canonical SMILES for 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol is CC(C)Oc1ccc(Oc2cnc3cc(CCO)ccc3n2)cc1.
What is the InChIKey of 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol?
The InChIKey is JDUWLDXBPMMHEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-13(2)23-15-4-6-16(7-5-15)24-19-12-20-18-11-14(9-10-22)3-8-17(18)21-19/h3-8,11-13,22H,9-10H2,1-2H3.
What are the key properties of 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol?
2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol has a molecular weight of 324.38 g/mol, XLogP of 3.74, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-propan-2-yloxyphenoxy)quinoxalin-6-yl]ethanol is sourced from PubChem (CID 91161860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).