2,6-dimethylimidazo[1,2-a]pyrazine-3-carboxylic acid

2,6-dimethylimidazo[1,2-a]pyrazine-3-carboxylic acid

CAS: 190381-50-1

Formula: C9H9N3O2

SMILES: CC1=C(N2C=C(C)N=CC2=N1)C(O)=O

IUPAC: 2,6-dimethylimidazo[1,2-a]pyrazine-3-carboxylic acid

InChI: InChI=1S/C9H9N3O2/c1-5-4-12-7(3-10-5)11-6(2)8(12)9(13)14/h3-4H,1-2H3,(H,13,14)

Composition: C (56.54%), H (4.75%), N (21.98%), O (16.74%)

Molar Mass: 191.19

Atom Count: 23

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	191.069476542
Formal Charge	0
FSP3	0.22
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DKTXOPQYFSOHFU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.1
Topological Polar Surface Area	67.49
Polarizability	18.33
Ring Count	2
Rotatable Bond Count	1

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