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tert-butyl N-{[1-(2-chloropyridine-3-carbonyl)piperidin-3-yl]methyl}carbamate

tert-butyl N-{[1-(2-chloropyridine-3-carbonyl)piperidin-3-yl]methyl}carbamate

Formula: C17H24ClN3O3

SMILES: CC(C)(C)OC(=O)NCC1CCCN(C1)C(=O)C1=C(Cl)N=CC=C1

IUPAC: tert-butyl N-{[1-(2-chloropyridine-3-carbonyl)piperidin-3-yl]methyl}carbamate

InChI: InChI=1/C17H24ClN3O3/c1-17(2,3)24-16(23)20-10-12-6-5-9-21(11-12)15(22)13-7-4-8-19-14(13)18/h4,7-8,12H,5-6,9-11H2,1-3H3,(H,20,23)

Composition: C (57.70%), H (6.84%), Cl (10.02%), N (11.88%), O (13.56%)

Molar Mass: 353.85

Atom Count: 48

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 353.1506193
Formal Charge 0
FSP3 0.59
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey UQUYAYCLEHXZPN-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.61
Topological Polar Surface Area 71.53
Polarizability 35.7
Ring Count 2
Rotatable Bond Count 5

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C17H24ClN3O3 Quote Only