N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine

C24H32N2 — CID 125043844

About N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine

N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine (PubChem CID 125043844) has the molecular formula C24H32N2 and a molecular weight of 348.53 g/mol. Its IUPAC name is N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine.

Molecular Properties

• Compound Name: N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine
• PubChem CID: 125043844
• Molecular Formula: C24H32N2
• Molecular Weight: 348.53 g/mol
• Exact Mass: 348.26
• IUPAC Name: N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine
• SMILES: Cc1ccc(/N=C/c2cc3c(cc2C)N(C(C)C)C(C)(C)C[C@H]3C)cc1
• InChI: InChI=1S/C24H32N2/c1-16(2)26-23-12-18(4)20(13-22(23)19(5)14-24(26,6)7)15-25-21-10-8-17(3)9-11-21/h8-13,15-16,19H,14H2,1-7H3/b25-15+/t19-/m1/s1
• InChIKey: YZNYSSKBXHUTDV-KWXFCVSUSA-N
• XLogP: 6.55
• TPSA: 15.60 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	348.53
LogP ≤ 5	6.55
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine?

The IUPAC name of N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine (CID 125043844) is N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine.

What is the SMILES notation for N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine?

The canonical SMILES for N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine is Cc1ccc(/N=C/c2cc3c(cc2C)N(C(C)C)C(C)(C)C[C@H]3C)cc1.

What is the InChIKey of N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine?

The InChIKey is YZNYSSKBXHUTDV-KWXFCVSUSA-N. The full InChI is InChI=1S/C24H32N2/c1-16(2)26-23-12-18(4)20(13-22(23)19(5)14-24(26,6)7)15-25-21-10-8-17(3)9-11-21/h8-13,15-16,19H,14H2,1-7H3/b25-15+/t19-/m1/s1.

What are the key properties of N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine?

N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine has a molecular weight of 348.53 g/mol, XLogP of 6.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-methylphenyl)-1-[(4R)-2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl]methanimine is sourced from PubChem (CID 125043844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).