6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one

C18H22N2O2 — CID 122179356

IUPAC6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one
SMILESCc1noc(C)c1-c1ccc2c(c1)C(C)(C)C(=O)C(C)(C)N2
InChIInChI=1S/C18H22N2O2/c1-10-15(11(2)22-20-10)12-7-8-14-13(9-12)17(3,4)16(21)18(5,6)19-14/h7-9,19H,1-6H3
InChIKeyVWCZQZNHWPQZGT-UHFFFAOYSA-N
MW298.39 g/mol
LogP4.01
Rot. Bonds1

About 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one

6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one (PubChem CID 122179356) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one.

Molecular Properties

Compound Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one
PubChem CID122179356
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one
SMILESCc1noc(C)c1-c1ccc2c(c1)C(C)(C)C(=O)C(C)(C)N2
InChIInChI=1S/C18H22N2O2/c1-10-15(11(2)22-20-10)12-7-8-14-13(9-12)17(3,4)16(21)18(5,6)19-14/h7-9,19H,1-6H3
InChIKeyVWCZQZNHWPQZGT-UHFFFAOYSA-N
XLogP4.01
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one with MolForge

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Launch Full Analysis

Related Compounds

6-(3,5-Dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one
CID 24860583
6-(3,5-Dimethyl-isoxazol-4-yl)-3-methyl-4-phenyl-3,4-dihydro-1H-quinazolin-2-one
CID 86273096
6-(3,5-Dimethylisoxazol-4-yl)-3-[(1-methyl-4-piperidyl)methyl]-4-phenyl-1,4-dihydroquinazolin-2-one
CID 86273098
6-(3,5-Dimethyl-isoxazol-4-yl)-3,4-dimethyl-4-phenyl-3,4-dihydro-1H-quinazolin-2-one
CID 86273586
6-(3,5-Dimethyl-1,2-oxazol-4-yl)-1-methyl-4-phenyl-3,4-dihydroquinazolin-2-one
CID 141488030
4-(benzylamino)-6-(3,5-dimethylisoxazol-4-yl)quinolin-2(1H)-one
CID 117625006
N-methyl-2-[2-[3-(3-nitrophenyl)-1,2-oxazol-5-yl]propan-2-yl]aniline
CID 2323538
7-chloro-6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one
CID 122179357
6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-2,2,4,4-tetramethyl-1H-quinolin-3-one
CID 122179358
6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-7,8,9,10-tetrahydro-1H-benzo[h]quinolin-3-one
CID 122179359
3-[(3S)-3-aminopiperidin-1-yl]-3-cyclopentyl-5-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-2-one
CID 155515565
4-Benzyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1-methyl-3,4-dihydroquinazolin-2-one
CID 168271125

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one?
The IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one (CID 122179356) is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one.
What is the SMILES notation for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one?
The canonical SMILES for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one is Cc1noc(C)c1-c1ccc2c(c1)C(C)(C)C(=O)C(C)(C)N2.
What is the InChIKey of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one?
The InChIKey is VWCZQZNHWPQZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-10-15(11(2)22-20-10)12-7-8-14-13(9-12)17(3,4)16(21)18(5,6)19-14/h7-9,19H,1-6H3.
What are the key properties of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one?
6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one has a molecular weight of 298.39 g/mol, XLogP of 4.01, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-2,2,4,4-tetramethyl-1H-quinolin-3-one is sourced from PubChem (CID 122179356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).