4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline

C92H115N13OS — CID 157312220

About 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline

4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 157312220) has the molecular formula C92H115N13OS and a molecular weight of 1451.09 g/mol. Its IUPAC name is 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

• Compound Name: 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline
• PubChem CID: 157312220
• Molecular Formula: C92H115N13OS
• Molecular Weight: 1451.09 g/mol
• Exact Mass: 1449.91
• IUPAC Name: 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline
• SMILES: CC1CCc2ccccc2N1.CN1CC=Cc2ccccc21.CN1CCCc2ccccc21.CN1CCOc2ccccc21.CN1CCSc2ccccc21.CN1CCc2ccccc21.CN1CCc2cccnc2C1.CN1CCc2ncccc2C1.CN1Cc2ccccc2C1.CN1Cc2cccnc2C1
• InChI: InChI=1S/C10H13N.C10H11N.C10H13N.2C9H12N2.C9H11NO.C9H11NS.2C9H11N.C8H10N2/c2*1-11-8-4-6-9-5-2-3-7-10(9)11;1-8-6-7-9-4-2-3-5-10(9)11-8;1-11-6-4-9-8(7-11)3-2-5-10-9;1-11-6-4-8-3-2-5-10-9(8)7-11;2*1-10-6-7-11-9-5-3-2-4-8(9)10;1-10-6-8-4-2-3-5-9(8)7-10;1-10-7-6-8-4-2-3-5-9(8)10;1-10-5-7-3-2-4-9-8(7)6-10/h2-3,5,7H,4,6,8H2,1H3;2-7H,8H2,1H3;2-5,8,11H,6-7H2,1H3;2*2-3,5H,4,6-7H2,1H3;2*2-5H,6-7H2,1H3;2*2-5H,6-7H2,1H3;2-4H,5-6H2,1H3
• InChIKey: BDEABVQOVFNMSX-UHFFFAOYSA-N
• XLogP: 16.87
• TPSA: 89.09 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 15
• Heavy Atoms: 107
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1451.09
LogP ≤ 5	16.87
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline?

The IUPAC name of 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline (CID 157312220) is 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline.

What is the SMILES notation for 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline?

The canonical SMILES for 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline is CC1CCc2ccccc2N1.CN1CC=Cc2ccccc21.CN1CCCc2ccccc21.CN1CCOc2ccccc21.CN1CCSc2ccccc21.CN1CCc2ccccc21.CN1CCc2cccnc2C1.CN1CCc2ncccc2C1.CN1Cc2ccccc2C1.CN1Cc2cccnc2C1.

What is the InChIKey of 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline?

The InChIKey is BDEABVQOVFNMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N.C10H11N.C10H13N.2C9H12N2.C9H11NO.C9H11NS.2C9H11N.C8H10N2/c2*1-11-8-4-6-9-5-2-3-7-10(9)11;1-8-6-7-9-4-2-3-5-10(9)11-8;1-11-6-4-9-8(7-11)3-2-5-10-9;1-11-6-4-8-3-2-5-10-9(8)7-11;2*1-10-6-7-11-9-5-3-2-4-8(9)10;1-10-6-8-4-2-3-5-9(8)7-10;1-10-7-6-8-4-2-3-5-9(8)10;1-10-5-7-3-2-4-9-8(7)6-10/h2-3,5,7H,4,6,8H2,1H3;2-7H,8H2,1H3;2-5,8,11H,6-7H2,1H3;2*2-3,5H,4,6-7H2,1H3;2*2-5H,6-7H2,1H3;2*2-5H,6-7H2,1H3;2-4H,5-6H2,1H3.

What are the key properties of 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline?

4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 1451.09 g/mol, XLogP of 16.87, 0 rotatable bonds, 1 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 4-methyl-2,3-dihydro-1,4-benzothiazine;4-methyl-2,3-dihydro-1,4-benzoxazine;1-methyl-2,3-dihydroindole;2-methyl-1,3-dihydroisoindole;6-methyl-7,8-dihydro-5H-1,6-naphthyridine;7-methyl-6,8-dihydro-5H-1,7-naphthyridine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-3,4-dihydro-2H-quinoline;1-methyl-2H-quinoline;2-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 157312220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).