N-benzyl-2-methoxy-4-(methylcarbamoylamino)-N-piperidin-1-ium-4-ylbenzamide chloride

CAS: 57645-40-6

Molecular Formula	`C22H29ClN4O3`
Molecular Weight	432.9 g/mol
Topological Polar Surface Area	87.3 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	432.1928
Heavy Atoms	30
Complexity	532.0

Chemical Identifiers

CAS Number	57645-40-6
SMILES	`CNC(=O)NC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3CC[NH2+]CC3)OC.[Cl-]`
InChIKey	`BVQPKDLNUIYLSR-UHFFFAOYSA-N`

📖 Product Overview

N-benzyl-2-methoxy-4-(methylcarbamoylamino)-N-piperidin-1-ium-4-ylbenzamide chloride (CAS: 57645-40-6) is a chemical compound with molecular formula C22H29ClN4O3 and molecular weight 432.9 g/mol. Its IUPAC systematic name is N-benzyl-2-methoxy-4-(methylcarbamoylamino)-N-piperidin-1-ium-4-ylbenzamide chloride. Topological Polar Surface Area 87.3 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 432.1928 Heavy Atoms 30 Complexity 532.0 InChI Key: BVQPKDLNUIYLSR-UHFFFAOYSA-N. SMILES: CNC(=O)NC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3CC[NH2+]CC3)OC.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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📚 Academic Support

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