2-amino-N-cyclohexyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

2-amino-N-cyclohexyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

CAS: 438234-89-0

Formula: C17H26N2OS

SMILES: CCC1CCC2=C(C1)SC(N)=C2C(=O)NC1CCCCC1

IUPAC: 2-amino-N-cyclohexyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1/C17H26N2OS/c1-2-11-8-9-13-14(10-11)21-16(18)15(13)17(20)19-12-6-4-3-5-7-12/h11-12H,2-10,18H2,1H3,(H,19,20)

Composition: C (66.63%), H (8.55%), N (9.14%), O (5.22%), S (10.46%)

Molar Mass: 306.47

Atom Count: 47

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	306.176584639
Formal Charge	0
FSP3	0.71
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	PWAWLLVCZOVEEN-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.58
Topological Polar Surface Area	55.12
Polarizability	33.44
Ring Count	3
Rotatable Bond Count	3

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