3-fluoro-4-[2-(piperidin-1-yl)ethoxy]aniline

3-fluoro-4-[2-(piperidin-1-yl)ethoxy]aniline

CAS: 851597-46-1

Formula: C13H19FN2O

SMILES: NC1=CC(F)=C(OCCN2CCCCC2)C=C1

IUPAC: 3-fluoro-4-[2-(piperidin-1-yl)ethoxy]aniline

InChI: InChI=1S/C13H19FN2O/c14-12-10-11(15)4-5-13(12)17-9-8-16-6-2-1-3-7-16/h4-5,10H,1-3,6-9,15H2

Composition: C (65.52%), H (8.04%), F (7.97%), N (11.76%), O (6.71%)

Molar Mass: 238.306

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	238.148141403
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	GXKQERCLTFQFAM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.6
Topological Polar Surface Area	38.49
Polarizability	25.49
Ring Count	2
Rotatable Bond Count	4

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