N-(3-amino-4-chlorophenyl)-2-(2,5-dimethylphenoxy)propanamide

N-(3-amino-4-chlorophenyl)-2-(2,5-dimethylphenoxy)propanamide

CAS: 1020054-88-9

Formula: C17H19ClN2O2

SMILES: CC(OC1=C(C)C=CC(C)=C1)C(=O)NC1=CC(N)=C(Cl)C=C1

IUPAC: N-(3-amino-4-chlorophenyl)-2-(2,5-dimethylphenoxy)propanamide

InChI: InChI=1/C17H19ClN2O2/c1-10-4-5-11(2)16(8-10)22-12(3)17(21)20-13-6-7-14(18)15(19)9-13/h4-9,12H,19H2,1-3H3,(H,20,21)

Composition: C (64.05%), H (6.01%), Cl (11.12%), N (8.79%), O (10.04%)

Molar Mass: 318.8

Atom Count: 41

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	318.1135056
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	IXYXDBMGFARHCG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.96
Topological Polar Surface Area	64.35
Polarizability	33.86
Ring Count	2
Rotatable Bond Count	4

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