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2-amino-N-cyclohexyl-4,5-dimethylthiophene-3-carboxamide

2-amino-N-cyclohexyl-4,5-dimethylthiophene-3-carboxamide

CAS: 667412-67-1

Formula: C13H20N2OS

SMILES: CC1=C(C)C(C(=O)NC2CCCCC2)=C(N)S1

IUPAC: 2-amino-N-cyclohexyl-4,5-dimethylthiophene-3-carboxamide

InChI: InChI=1S/C13H20N2OS/c1-8-9(2)17-12(14)11(8)13(16)15-10-6-4-3-5-7-10/h10H,3-7,14H2,1-2H3,(H,15,16)

Composition: C (61.87%), H (7.99%), N (11.10%), O (6.34%), S (12.70%)

Molar Mass: 252.38

Atom Count: 37

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 252.129634446
Formal Charge 0
FSP3 0.62
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey ZEFSJUNPLLCVPS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.11
Topological Polar Surface Area 55.12
Polarizability 26.81
Ring Count 2
Rotatable Bond Count 2

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95% <2 Days 667412-67-1 $134.76$134.76
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