2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline

C18H19NO — CID 15834051

IUPAC2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline
SMILESCOc1ccc(C2(C)C=C(C)c3ccccc3N2)cc1
InChIInChI=1S/C18H19NO/c1-13-12-18(2,14-8-10-15(20-3)11-9-14)19-17-7-5-4-6-16(13)17/h4-12,19H,1-3H3
InChIKeyCTVWFBFLBRNPHQ-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.44
Rot. Bonds2

About 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline

2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline (PubChem CID 15834051) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline
PubChem CID15834051
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline
SMILESCOc1ccc(C2(C)C=C(C)c3ccccc3N2)cc1
InChIInChI=1S/C18H19NO/c1-13-12-18(2,14-8-10-15(20-3)11-9-14)19-17-7-5-4-6-16(13)17/h4-12,19H,1-3H3
InChIKeyCTVWFBFLBRNPHQ-UHFFFAOYSA-N
XLogP4.44
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_alk_C(1)', 'substructure': 'N/A'}

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Related Compounds

2,2-bis(4-methoxyphenyl)-1H-indol-3-one
CID 138738671
2-(4-methoxyphenyl)-2,4-dimethyl-1,3-dihydro-1,3,4-benzotriazepin-5-one
CID 10732770
2,2,4-trimethyl-1H-quinoline;hydrochloride
CID 6602975
5-(4-methoxyphenyl)-5-methyl-6H-tetrazolo[1,5-c]quinazoline
CID 138006007
4-methyl-2,2-diphenyl-1H-quinoline
CID 15834052
7-methoxy-2,2,4-trimethyl-1H-quinoline
CID 643478
5-(4-chlorophenyl)-2-(4-methoxyphenyl)-5-methyl-6H-[1,2,4]triazolo[1,5-c]quinazoline
CID 136544798
(5R)-5-(4-chlorophenyl)-2-(4-methoxyphenyl)-5-methyl-6H-[1,2,4]triazolo[1,5-c]quinazoline
CID 137124871
2,3-bis(4-methoxyphenyl)-5,5-dimethyl-6H-imidazo[1,2-c]quinazoline
CID 11395802
9,9-bis(4-methoxyphenyl)fluorene;ethane
CID 159536685
2-(4-methoxyphenyl)-2-phenacyl-1H-indol-3-one
CID 154722470
(3R)-3-(4-methoxyphenyl)-3-phenyl-2H-isoindol-1-one
CID 102494819

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline?
The IUPAC name of 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline (CID 15834051) is 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline.
What is the SMILES notation for 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline?
The canonical SMILES for 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline is COc1ccc(C2(C)C=C(C)c3ccccc3N2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline?
The InChIKey is CTVWFBFLBRNPHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-13-12-18(2,14-8-10-15(20-3)11-9-14)19-17-7-5-4-6-16(13)17/h4-12,19H,1-3H3.
What are the key properties of 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline?
2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline has a molecular weight of 265.36 g/mol, XLogP of 4.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2,4-dimethyl-1H-quinoline is sourced from PubChem (CID 15834051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).