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tert-butyl 3-(phenylamino)piperidine-1-carboxylate

tert-butyl 3-(phenylamino)piperidine-1-carboxylate

CAS: 183207-67-2

Formula: C16H24N2O2

SMILES: CC(C)(C)OC(=O)N1CCCC(C1)NC1=CC=CC=C1

IUPAC: tert-butyl 3-(phenylamino)piperidine-1-carboxylate

InChI: InChI=1/C16H24N2O2/c1-16(2,3)20-15(19)18-11-7-10-14(12-18)17-13-8-5-4-6-9-13/h4-6,8-9,14,17H,7,10-12H2,1-3H3

Composition: C (69.53%), H (8.75%), N (10.14%), O (11.58%)

Molar Mass: 276.38

Atom Count: 44

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 276.183778021
Formal Charge 0
FSP3 0.56
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LJJKJXBLMQFLRM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.18
Topological Polar Surface Area 41.57
Polarizability 31.06
Ring Count 2
Rotatable Bond Count 4

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