2,2,4-trimethyl-1H-quinolin-7-ol

C12H15NO — CID 23433587

IUPAC2,2,4-trimethyl-1H-quinolin-7-ol
SMILESCC1=CC(C)(C)Nc2cc(O)ccc21
InChIInChI=1S/C12H15NO/c1-8-7-12(2,3)13-11-6-9(14)4-5-10(8)11/h4-7,13-14H,1-3H3
InChIKeyGDXFUCLITVBASU-UHFFFAOYSA-N
MW189.26 g/mol
LogP3.00
Rot. Bonds

About 2,2,4-trimethyl-1H-quinolin-7-ol

2,2,4-trimethyl-1H-quinolin-7-ol (PubChem CID 23433587) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 2,2,4-trimethyl-1H-quinolin-7-ol.

Molecular Properties

Compound Name2,2,4-trimethyl-1H-quinolin-7-ol
PubChem CID23433587
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name2,2,4-trimethyl-1H-quinolin-7-ol
SMILESCC1=CC(C)(C)Nc2cc(O)ccc21
InChIInChI=1S/C12H15NO/c1-8-7-12(2,3)13-11-6-9(14)4-5-10(8)11/h4-7,13-14H,1-3H3
InChIKeyGDXFUCLITVBASU-UHFFFAOYSA-N
XLogP3.00
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-2,2,4-trimethyl-1H-quinoline
CID 643478
1-ethyl-2,2,4-trimethylquinolin-7-ol;7-methoxy-2,2,4-trimethyl-1H-quinoline
CID 160805076
2,2,4-trimethyl-1H-quinoline;hydrochloride
CID 6602975
7-[(dimethylamino)methyl]-2,2,4-trimethyl-1H-quinolin-6-ol
CID 2835209
3-methoxy-4-[5-[2-(2-methoxyphenyl)ethyl]-2,2,4-trimethyl-1H-quinolin-6-yl]phenol
CID 58506236
6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinoline
CID 23433471
3-[5-[(5-fluoro-2-methylphenoxy)methyl]-2,2,4-trimethyl-1H-quinolin-6-yl]-4-methoxyphenol
CID 16660653
6-ethoxy-2,2,4-trimethyl-1H-quinoline;oxoiron
CID 67924358
2,2,4-trimethyl-6-(2,3,4-trifluorophenyl)-1H-quinoline
CID 23433581
2,2,4-trimethyl-N-(4-methylphenyl)-1H-quinolin-6-amine
CID 154263778
2,2,4-trimethyl-6-(3-methylphenyl)-1H-quinoline
CID 23433463
(7-hydroxy-2,2,4-trimethyl-1H-quinolin-6-yl)-(2,3,4,5-tetrafluoro-6-methylphenyl)methanone
CID 58214332

Frequently Asked Questions

What is the IUPAC name of 2,2,4-trimethyl-1H-quinolin-7-ol?
The IUPAC name of 2,2,4-trimethyl-1H-quinolin-7-ol (CID 23433587) is 2,2,4-trimethyl-1H-quinolin-7-ol.
What is the SMILES notation for 2,2,4-trimethyl-1H-quinolin-7-ol?
The canonical SMILES for 2,2,4-trimethyl-1H-quinolin-7-ol is CC1=CC(C)(C)Nc2cc(O)ccc21.
What is the InChIKey of 2,2,4-trimethyl-1H-quinolin-7-ol?
The InChIKey is GDXFUCLITVBASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-8-7-12(2,3)13-11-6-9(14)4-5-10(8)11/h4-7,13-14H,1-3H3.
What are the key properties of 2,2,4-trimethyl-1H-quinolin-7-ol?
2,2,4-trimethyl-1H-quinolin-7-ol has a molecular weight of 189.26 g/mol, XLogP of 3.00, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4-trimethyl-1H-quinolin-7-ol is sourced from PubChem (CID 23433587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).