3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol

C14H19NO2 — CID 102649826

IUPAC3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol
SMILESCN(C)c1cccc(C(O)C2=CCCCO2)c1
InChIInChI=1S/C14H19NO2/c1-15(2)12-7-5-6-11(10-12)14(16)13-8-3-4-9-17-13/h5-8,10,14,16H,3-4,9H2,1-2H3
InChIKeyGCYODBULRUTTLG-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.48
Rot. Bonds3

About 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol

3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol (PubChem CID 102649826) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol
PubChem CID102649826
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol
SMILESCN(C)c1cccc(C(O)C2=CCCCO2)c1
InChIInChI=1S/C14H19NO2/c1-15(2)12-7-5-6-11(10-12)14(16)13-8-3-4-9-17-13/h5-8,10,14,16H,3-4,9H2,1-2H3
InChIKeyGCYODBULRUTTLG-UHFFFAOYSA-N
XLogP2.48
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3,4-dihydro-2H-pyran-6-yl(ethylamino)methyl]-N,N-dimethylaniline
CID 102649394
(4-tert-butylphenyl)-(3,4-dihydro-2H-pyran-6-yl)methanol
CID 102646462
2,3-dihydrofuran-5-yl(phenyl)methanol
CID 102650514
2,3-dihydro-1,4-benzodioxin-5-yl(3,4-dihydro-2H-pyran-6-yl)methanol
CID 102649829
cyclohexyl-[3-(dimethylamino)phenyl]methanol
CID 105100536
(3,5-dimethoxyphenyl)-[3-(dimethylamino)phenyl]methanol
CID 105114451
[3-(dimethylamino)phenyl]-(2-fluoro-5-methylphenyl)methanol
CID 105094125
3,4-dihydro-2H-pyran-6-yl-(3-methyl-2-pyridinyl)methanol
CID 102649860
[3-(dimethylamino)phenyl]-(methylamino)methanol
CID 59725197
1-[3-(dimethylamino)phenyl]-2,2-dimethylpropan-1-ol
CID 105096689
(3-bromoquinolin-2-yl)-(3,4-dihydro-2H-pyran-6-yl)methanol
CID 102654812
1-(3,4-dihydro-2H-pyran-6-yl)-2-(dimethylamino)-2-methylpropan-1-ol
CID 102654733

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol (CID 102649826) is 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol is CN(C)c1cccc(C(O)C2=CCCCO2)c1.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol?
The InChIKey is GCYODBULRUTTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-15(2)12-7-5-6-11(10-12)14(16)13-8-3-4-9-17-13/h5-8,10,14,16H,3-4,9H2,1-2H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol?
3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol has a molecular weight of 233.31 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-6-yl-[3-(dimethylamino)phenyl]methanol is sourced from PubChem (CID 102649826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).