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ethyl 2-(piperidin-1-yl)-1,3-thiazole-4-carboxylate

ethyl 2-(piperidin-1-yl)-1,3-thiazole-4-carboxylate

CAS: 126533-98-0

Formula: C11H16N2O2S

SMILES: CCOC(=O)C1=CSC(=N1)N1CCCCC1

IUPAC: ethyl 2-(piperidin-1-yl)-1,3-thiazole-4-carboxylate

InChI: InChI=1S/C11H16N2O2S/c1-2-15-10(14)9-8-16-11(12-9)13-6-4-3-5-7-13/h8H,2-7H2,1H3

Composition: C (54.98%), H (6.71%), N (11.66%), O (13.31%), S (13.34%)

Molar Mass: 240.32

Atom Count: 32

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 240.093248937
Formal Charge 0
FSP3 0.64
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey YDNOYPUXHJNTPT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.71
Topological Polar Surface Area 42.43
Polarizability 24.05
Ring Count 2
Rotatable Bond Count 4

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