8-methoxy-2,2,4-trimethyl-1H-quinoline

C13H17NO — CID 604775

IUPAC8-methoxy-2,2,4-trimethyl-1H-quinoline
SMILESCOc1cccc2c1NC(C)(C)C=C2C
InChIInChI=1S/C13H17NO/c1-9-8-13(2,3)14-12-10(9)6-5-7-11(12)15-4/h5-8,14H,1-4H3
InChIKeyKRUCENDXMOILSL-UHFFFAOYSA-N
MW203.28 g/mol
LogP3.30
Rot. Bonds1

About 8-methoxy-2,2,4-trimethyl-1H-quinoline

8-methoxy-2,2,4-trimethyl-1H-quinoline (PubChem CID 604775) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 8-methoxy-2,2,4-trimethyl-1H-quinoline.

Molecular Properties

Compound Name8-methoxy-2,2,4-trimethyl-1H-quinoline
PubChem CID604775
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name8-methoxy-2,2,4-trimethyl-1H-quinoline
SMILESCOc1cccc2c1NC(C)(C)C=C2C
InChIInChI=1S/C13H17NO/c1-9-8-13(2,3)14-12-10(9)6-5-7-11(12)15-4/h5-8,14H,1-4H3
InChIKeyKRUCENDXMOILSL-UHFFFAOYSA-N
XLogP3.30
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ethoxyquin
CID 3293
2',2''-Dimethoxy-4',4''-biacetanilide
CID 54986
4-methoxy-2-methyl-N-phenylaniline
CID 162461
8-Methoxy-4-methylquinolin-2(1H)-one
CID 782123
8-Methoxy-1,4-dimethyl-1h-quinolin-2-one
CID 5324988
2-Methoxy-6-methylaniline
CID 459249
Quinoline, 1,2,3,4-tetrahydro-6-methoxy-
CID 67113
2-Hydroxy-6-methoxy-4-methylquinoline
CID 220017
8-Methoxy-4-methyl-3,4-dihydro-quinazolin-2-ylamine
CID 16006606
Edulitine
CID 826073
4,8-dimethoxy-N-methyl-2-quinolone
CID 10680379
8-Methoxy-2-methylquinolin-4-ol
CID 308133

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2,2,4-trimethyl-1H-quinoline?
The IUPAC name of 8-methoxy-2,2,4-trimethyl-1H-quinoline (CID 604775) is 8-methoxy-2,2,4-trimethyl-1H-quinoline.
What is the SMILES notation for 8-methoxy-2,2,4-trimethyl-1H-quinoline?
The canonical SMILES for 8-methoxy-2,2,4-trimethyl-1H-quinoline is COc1cccc2c1NC(C)(C)C=C2C.
What is the InChIKey of 8-methoxy-2,2,4-trimethyl-1H-quinoline?
The InChIKey is KRUCENDXMOILSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-9-8-13(2,3)14-12-10(9)6-5-7-11(12)15-4/h5-8,14H,1-4H3.
What are the key properties of 8-methoxy-2,2,4-trimethyl-1H-quinoline?
8-methoxy-2,2,4-trimethyl-1H-quinoline has a molecular weight of 203.28 g/mol, XLogP of 3.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2,2,4-trimethyl-1H-quinoline is sourced from PubChem (CID 604775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).