1-(3,4-dimethoxybenzoyl)piperidine-4-carboxylic acid

1-(3,4-dimethoxybenzoyl)piperidine-4-carboxylic acid

CAS: 510739-78-3

Formula: C15H19NO5

SMILES: COC1=C(OC)C=C(C=C1)C(=O)N1CCC(CC1)C(O)=O

IUPAC: 1-(3,4-dimethoxybenzoyl)piperidine-4-carboxylic acid

InChI: InChI=1S/C15H19NO5/c1-20-12-4-3-11(9-13(12)21-2)14(17)16-7-5-10(6-8-16)15(18)19/h3-4,9-10H,5-8H2,1-2H3,(H,18,19)

Composition: C (61.42%), H (6.53%), N (4.78%), O (27.27%)

Molar Mass: 293.319

Atom Count: 40

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	293.126322716
Formal Charge	0
FSP3	0.47
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	GAKOEWXKEAHTES-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.24
Topological Polar Surface Area	76.07
Polarizability	29.1
Ring Count	2
Rotatable Bond Count	4

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