N-[(2,3,4-trimethoxyphenyl)methyl]cyclopentanamine hydrobromide

N-[(2,3,4-trimethoxyphenyl)methyl]cyclopentanamine hydrobromide

CAS: 1609408-86-7

Formula: C15H24BrNO3

SMILES: Br.COC1=CC=C(CNC2CCCC2)C(OC)=C1OC

IUPAC: N-[(2,3,4-trimethoxyphenyl)methyl]cyclopentanamine hydrobromide

InChI: InChI=1S/C15H23NO3.BrH/c1-17-13-9-8-11(14(18-2)15(13)19-3)10-16-12-6-4-5-7-12;/h8-9,12,16H,4-7,10H2,1-3H3;1H

Composition: C (52.03%), H (6.99%), Br (23.08%), N (4.05%), O (13.86%)

Molar Mass: 346.265

Atom Count: 44

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	345.093957
Formal Charge	0
FSP3	0.6
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	HNAJZDJXOYOQAE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.11
Topological Polar Surface Area	39.72
Polarizability	29.73
Ring Count	2
Rotatable Bond Count	6

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