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thiomorpholine-3-carboxamide

thiomorpholine-3-carboxamide

CAS: 103742-31-0

Formula: C5H10N2OS

SMILES: NC(=O)C1CSCCN1

IUPAC: thiomorpholine-3-carboxamide

InChI: InChI=1/C5H10N2OS/c6-5(8)4-3-9-2-1-7-4/h4,7H,1-3H2,(H2,6,8)

Composition: C (41.08%), H (6.89%), N (19.16%), O (10.94%), S (21.93%)

Molar Mass: 146.21

Atom Count: 19

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 146.051384124
Formal Charge 0
FSP3 0.8
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey WTBJIFNMKOKRJX-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.71
Topological Polar Surface Area 55.12
Polarizability 15.03
Ring Count 1
Rotatable Bond Count 1

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