3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol

C14H14N2O2 — CID 105124475

IUPAC3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol
SMILESOC(C1=COCCC1)c1cccc2nccnc12
InChIInChI=1S/C14H14N2O2/c17-14(10-3-2-8-18-9-10)11-4-1-5-12-13(11)16-7-6-15-12/h1,4-7,9,14,17H,2-3,8H2
InChIKeyCFLZVDYBMABJQF-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.36
Rot. Bonds2

About 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol

3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol (PubChem CID 105124475) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol
PubChem CID105124475
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol
SMILESOC(C1=COCCC1)c1cccc2nccnc12
InChIInChI=1S/C14H14N2O2/c17-14(10-3-2-8-18-9-10)11-4-1-5-12-13(11)16-7-6-15-12/h1,4-7,9,14,17H,2-3,8H2
InChIKeyCFLZVDYBMABJQF-UHFFFAOYSA-N
XLogP2.36
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dihydro-2H-pyran-5-yl-(2-methoxy-3-pyridinyl)methanol
CID 105124451
(4-chlorophenyl)-quinoxalin-5-ylmethanol
CID 105120341
3,4-dihydro-2H-pyran-5-yl-(2,6-dimethyl-3-pyridinyl)methanol
CID 105124497
cycloheptyl(quinoxalin-5-yl)methanol
CID 105122139
1-quinoxalin-5-ylprop-2-yn-1-ol
CID 105106188
3,4-dihydro-2H-pyran-5-yl(pyrazolo[1,5-a]pyridin-3-yl)methanol
CID 103129177
quinoxalin-5-yl(thiophen-3-yl)methanol
CID 105102725
3,4-dihydro-2H-pyran-5-yl-(5-methylpyrazin-2-yl)methanol
CID 105124479
N-[3,4-dihydro-2H-pyran-5-yl(quinolin-8-yl)methyl]propan-1-amine
CID 105179292
(5-chlorofuran-2-yl)-(3,4-dihydro-2H-pyran-5-yl)methanol
CID 106693982
(3-chlorothiophen-2-yl)-quinoxalin-5-ylmethanol
CID 107361966
(2-bromo-5-fluorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methanol
CID 115831581

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol?
The IUPAC name of 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol (CID 105124475) is 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol.
What is the SMILES notation for 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol?
The canonical SMILES for 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol is OC(C1=COCCC1)c1cccc2nccnc12.
What is the InChIKey of 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol?
The InChIKey is CFLZVDYBMABJQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c17-14(10-3-2-8-18-9-10)11-4-1-5-12-13(11)16-7-6-15-12/h1,4-7,9,14,17H,2-3,8H2.
What are the key properties of 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol?
3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol has a molecular weight of 242.28 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol is sourced from PubChem (CID 105124475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).