N-(3-acetylphenyl)-2-(4-chloro-2-methylphenoxy)propanamide

N-(3-acetylphenyl)-2-(4-chloro-2-methylphenoxy)propanamide

CAS: 13791-88-3

Formula: C18H18ClNO3

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

IUPAC: N-(3-acetylphenyl)-2-(4-chloro-2-methylphenoxy)propanamide

InChI: InChI=1/C18H18ClNO3/c1-11-9-15(19)7-8-17(11)23-13(3)18(22)20-16-6-4-5-14(10-16)12(2)21/h4-10,13H,1-3H3,(H,20,22)

Composition: C (65.16%), H (5.47%), Cl (10.68%), N (4.22%), O (14.47%)

Molar Mass: 331.8

Atom Count: 41

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	331.0975211
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	AUCWPLDCUAFMOQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.63
Topological Polar Surface Area	55.4
Polarizability	34.69
Ring Count	2
Rotatable Bond Count	5

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