[3-(dimethylamino)phenyl]-quinolin-8-ylmethanol

C18H18N2O — CID 105118763

IUPAC[3-(dimethylamino)phenyl]-quinolin-8-ylmethanol
SMILESCN(C)c1cccc(C(O)c2cccc3cccnc23)c1
InChIInChI=1S/C18H18N2O/c1-20(2)15-9-3-7-14(12-15)18(21)16-10-4-6-13-8-5-11-19-17(13)16/h3-12,18,21H,1-2H3
InChIKeyWBOAYFSTURGXIQ-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.38
Rot. Bonds3

About [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol

[3-(dimethylamino)phenyl]-quinolin-8-ylmethanol (PubChem CID 105118763) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol.

Molecular Properties

Compound Name[3-(dimethylamino)phenyl]-quinolin-8-ylmethanol
PubChem CID105118763
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name[3-(dimethylamino)phenyl]-quinolin-8-ylmethanol
SMILESCN(C)c1cccc(C(O)c2cccc3cccnc23)c1
InChIInChI=1S/C18H18N2O/c1-20(2)15-9-3-7-14(12-15)18(21)16-10-4-6-13-8-5-11-19-17(13)16/h3-12,18,21H,1-2H3
InChIKeyWBOAYFSTURGXIQ-UHFFFAOYSA-N
XLogP3.38
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromo-4-fluorophenyl)-quinolin-8-ylmethanol
CID 81216271
(2,4-dimethylphenyl)-quinolin-8-ylmethanol
CID 62875063
2-(dimethylamino)-2-methyl-1-quinolin-8-ylpropan-1-ol
CID 81220750
[3-(dimethylamino)phenyl]-(1-methylimidazol-2-yl)methanol
CID 105098831
(2,5-dichlorophenyl)-[3-(dimethylamino)phenyl]methanol
CID 105093347
(2-chloro-3-methylphenyl)-quinolin-8-ylmethanol
CID 115826971
(2-methylpyrimidin-4-yl)-quinolin-8-ylmethanol
CID 115527954
quinolin-8-yl(1H-1,2,4-triazol-5-yl)methanol
CID 81219926
(2,3-difluoro-4-methylphenyl)-[3-(dimethylamino)phenyl]methanol
CID 107516253
(4-methyl-3-pyridinyl)-quinolin-8-ylmethanol
CID 66273941
[3-(dimethylamino)phenyl]-(2-fluoro-3-methoxyphenyl)methanol
CID 105120885
3-[amino(quinolin-7-yl)methyl]-N,N-dimethylaniline
CID 105172596

Frequently Asked Questions

What is the IUPAC name of [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol?
The IUPAC name of [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol (CID 105118763) is [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol.
What is the SMILES notation for [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol?
The canonical SMILES for [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol is CN(C)c1cccc(C(O)c2cccc3cccnc23)c1.
What is the InChIKey of [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol?
The InChIKey is WBOAYFSTURGXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-20(2)15-9-3-7-14(12-15)18(21)16-10-4-6-13-8-5-11-19-17(13)16/h3-12,18,21H,1-2H3.
What are the key properties of [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol?
[3-(dimethylamino)phenyl]-quinolin-8-ylmethanol has a molecular weight of 278.36 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(dimethylamino)phenyl]-quinolin-8-ylmethanol is sourced from PubChem (CID 105118763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).