1-(2-phenylethyl)piperidin-3-amine; sulfuric acid

1-(2-phenylethyl)piperidin-3-amine; sulfuric acid

CAS: 1185299-91-5

Formula: C13H22N2O4S

SMILES: OS(O)(=O)=O.NC1CCCN(CCC2=CC=CC=C2)C1

IUPAC: 1-(2-phenylethyl)piperidin-3-amine; sulfuric acid

InChI: InChI=1/C13H20N2.H2O4S/c14-13-7-4-9-15(11-13)10-8-12-5-2-1-3-6-12;1-5(2,3)4/h1-3,5-6,13H,4,7-11,14H2;(H2,1,2,3,4)

Composition: C (51.64%), H (7.33%), N (9.26%), O (21.16%), S (10.60%)

Molar Mass: 302.39

Atom Count: 42

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	302.13002837
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MSEYJKOFUJZPFQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.52
Topological Polar Surface Area	29.26
Polarizability	25.52
Ring Count	2
Rotatable Bond Count	3

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