N-[(2,4-dimethoxyphenyl)methyl]-2-methylcyclohexan-1-amine hydrobromide

N-[(2,4-dimethoxyphenyl)methyl]-2-methylcyclohexan-1-amine hydrobromide

CAS: 1609406-25-8

Formula: C16H26BrNO2

SMILES: Br.COC1=CC(OC)=C(CNC2CCCCC2C)C=C1

IUPAC: N-[(2,4-dimethoxyphenyl)methyl]-2-methylcyclohexan-1-amine hydrobromide

InChI: InChI=1/C16H25NO2.BrH/c1-12-6-4-5-7-15(12)17-11-13-8-9-14(18-2)10-16(13)19-3;/h8-10,12,15,17H,4-7,11H2,1-3H3;1H

Composition: C (55.82%), H (7.61%), Br (23.21%), N (4.07%), O (9.29%)

Molar Mass: 344.293

Atom Count: 46

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	343.114692
Formal Charge	0
FSP3	0.62
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WFLSNJFRTYTGDX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.72
Topological Polar Surface Area	30.49
Polarizability	30.9
Ring Count	2
Rotatable Bond Count	5

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