N-[2-(2-methylphenoxy)propyl]-3-(3-phenylpropoxy)aniline

N-[2-(2-methylphenoxy)propyl]-3-(3-phenylpropoxy)aniline

CAS: 1040690-55-8

Formula: C25H29NO2

SMILES: CC(CNC1=CC(OCCCC2=CC=CC=C2)=CC=C1)OC1=C(C)C=CC=C1

IUPAC: N-[2-(2-methylphenoxy)propyl]-3-(3-phenylpropoxy)aniline

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

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	1
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	JQYJLCSSEFATHN-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	116.7
Topological Polar Surface Area	30.49
Polarizability	44.8
Ring Count	3
Rotatable Bond Count	10

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