3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoic acid

3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoic acid

CAS: 732298-45-2

Formula: C14H20N2O3

SMILES: COC1=C(C=CC=C1)N1CCN(CCC(O)=O)CC1

IUPAC: 3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoic acid

InChI: InChI=1S/C14H20N2O3/c1-19-13-5-3-2-4-12(13)16-10-8-15(9-11-16)7-6-14(17)18/h2-5H,6-11H2,1H3,(H,17,18)

Composition: C (63.62%), H (7.63%), N (10.60%), O (18.16%)

Molar Mass: 264.325

Atom Count: 39

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	264.147392512
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	WQQWTUBIANMMPU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.78
Topological Polar Surface Area	53.01
Polarizability	28.2
Ring Count	2
Rotatable Bond Count	5

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