2,5-dimethyl-N-[2-(3-methylphenoxy)propyl]aniline

2,5-dimethyl-N-[2-(3-methylphenoxy)propyl]aniline

CAS: 1040687-41-9

Formula: C18H23NO

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

IUPAC: 2,5-dimethyl-N-[2-(3-methylphenoxy)propyl]aniline

InChI: InChI=1/C18H23NO/c1-13-6-5-7-17(10-13)20-16(4)12-19-18-11-14(2)8-9-15(18)3/h5-11,16,19H,12H2,1-4H3

Composition: C (80.26%), H (8.61%), N (5.20%), O (5.94%)

Molar Mass: 269.388

Atom Count: 43

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	269.177964365
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YVYXQWLJHLMCKU-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	86.35
Topological Polar Surface Area	21.26
Polarizability	32.6
Ring Count	2
Rotatable Bond Count	5

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