4-(2,2-dimethyl-3-oxopiperazin-1-yl)-4-oxobutanoic acid

4-(2,2-dimethyl-3-oxopiperazin-1-yl)-4-oxobutanoic acid

CAS: 626223-70-9

Formula: C10H16N2O4

SMILES: CC1(C)N(CCNC1=O)C(=O)CCC(O)=O

IUPAC: 4-(2,2-dimethyl-3-oxopiperazin-1-yl)-4-oxobutanoic acid

InChI: InChI=1S/C10H16N2O4/c1-10(2)9(16)11-5-6-12(10)7(13)3-4-8(14)15/h3-6H2,1-2H3,(H,11,16)(H,14,15)

Composition: C (52.62%), H (7.07%), N (12.27%), O (28.04%)

Molar Mass: 228.248

Atom Count: 32

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	228.111007003
Formal Charge	0
FSP3	0.7
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	WECARCQDMIODCT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.19
Topological Polar Surface Area	86.71
Polarizability	21.49
Ring Count	1
Rotatable Bond Count	3

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