[3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol

C14H16N2O2 — CID 105067102

IUPAC[3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol
SMILESCN(C)c1cccc(Oc2cnccc2CO)c1
InChIInChI=1S/C14H16N2O2/c1-16(2)12-4-3-5-13(8-12)18-14-9-15-7-6-11(14)10-17/h3-9,17H,10H2,1-2H3
InChIKeyUMDODUHQXUVQRD-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.43
Rot. Bonds4

About [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol

[3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol (PubChem CID 105067102) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol
PubChem CID105067102
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name[3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol
SMILESCN(C)c1cccc(Oc2cnccc2CO)c1
InChIInChI=1S/C14H16N2O2/c1-16(2)12-4-3-5-13(8-12)18-14-9-15-7-6-11(14)10-17/h3-9,17H,10H2,1-2H3
InChIKeyUMDODUHQXUVQRD-UHFFFAOYSA-N
XLogP2.43
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[3-(aminomethyl)-4-pyridinyl]oxy]-N,N-dimethylaniline
CID 81251232
[3-(3,4-dichlorophenoxy)-4-pyridinyl]methanol
CID 105067098
[3-chloro-4-[3-(dimethylamino)phenoxy]phenyl]methanol
CID 81152356
[3-(4-chloro-3-fluorophenoxy)-4-pyridinyl]methanol
CID 105067210
[6-[3-(dimethylamino)phenoxy]-5-methyl-3-pyridinyl]methanol
CID 80628307
4-(chloromethyl)-3-(3-ethylphenoxy)pyridine
CID 105067622
3-[[5-(aminomethyl)-2-methyl-4-pyridinyl]oxy]-N,N-dimethylaniline
CID 81251021
[4-[3-(dimethylamino)phenoxy]-3-nitrophenyl]methanol
CID 61230213
2-[2-[[4-(hydroxymethyl)-3-pyridinyl]oxy]phenyl]ethanol
CID 107713866
N-[[3-(3-ethoxyphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075595
[3-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methanol
CID 105067223
(4-phenoxy-3-pyridinyl)methanol
CID 67434840

Frequently Asked Questions

What is the IUPAC name of [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol?
The IUPAC name of [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol (CID 105067102) is [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol.
What is the SMILES notation for [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol?
The canonical SMILES for [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol is CN(C)c1cccc(Oc2cnccc2CO)c1.
What is the InChIKey of [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol?
The InChIKey is UMDODUHQXUVQRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-16(2)12-4-3-5-13(8-12)18-14-9-15-7-6-11(14)10-17/h3-9,17H,10H2,1-2H3.
What are the key properties of [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol?
[3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol has a molecular weight of 244.29 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(dimethylamino)phenoxy]-4-pyridinyl]methanol is sourced from PubChem (CID 105067102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).