N-[2-(2,6-dimethylphenoxy)ethyl]-2-(3-phenylpropoxy)aniline

N-[2-(2,6-dimethylphenoxy)ethyl]-2-(3-phenylpropoxy)aniline

CAS: 1040687-64-6

Formula: C25H29NO2

SMILES: CC1=CC=CC(C)=C1OCCNC1=C(OCCCC2=CC=CC=C2)C=CC=C1

IUPAC: N-[2-(2,6-dimethylphenoxy)ethyl]-2-(3-phenylpropoxy)aniline

InChI: InChI=1S/C25H29NO2/c1-20-10-8-11-21(2)25(20)28-19-17-26-23-15-6-7-16-24(23)27-18-9-14-22-12-4-3-5-13-22/h3-8,10-13,15-16,26H,9,14,17-19H2,1-2H3

Composition: C (79.96%), H (7.78%), N (3.73%), O (8.52%)

Molar Mass: 375.512

Atom Count: 57

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	375.219829178
Formal Charge	0
FSP3	0.28
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	UIQZDYYKQXTJIK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	117.32
Topological Polar Surface Area	30.49
Polarizability	44.72
Ring Count	3
Rotatable Bond Count	10

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