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1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methylpiperidine

1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methylpiperidine

CAS: 478064-79-8

Formula: C10H15ClN2S

SMILES: CC1CCCN(CC2=CN=C(Cl)S2)C1

IUPAC: 1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methylpiperidine

InChI: InChI=1/C10H15ClN2S/c1-8-3-2-4-13(6-8)7-9-5-12-10(11)14-9/h5,8H,2-4,6-7H2,1H3

Composition: C (52.05%), H (6.55%), Cl (15.36%), N (12.14%), S (13.89%)

Molar Mass: 230.75

Atom Count: 29

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 230.0644474
Formal Charge 0
FSP3 0.7
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey XWHGDDRUUWBESD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.23
Topological Polar Surface Area 16.13
Polarizability 23.79
Ring Count 2
Rotatable Bond Count 2

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