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1-(piperidin-1-yl)hexadecan-1-one

1-(piperidin-1-yl)hexadecan-1-one

CAS: 4629-02-1

Formula: C21H41NO

SMILES: CCCCCCCCCCCCCCCC(=O)N1CCCCC1

IUPAC: 1-(piperidin-1-yl)hexadecan-1-one

InChI: InChI=1S/C21H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21(23)22-19-16-14-17-20-22/h2-20H2,1H3

Composition: C (77.95%), H (12.77%), N (4.33%), O (4.94%)

Molar Mass: 323.565

Atom Count: 64

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 323.318814944
Formal Charge 0
FSP3 0.95
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey SBWUACYNOBUPAH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 100.84
Topological Polar Surface Area 20.31
Polarizability 39.92
Ring Count 1
Rotatable Bond Count 14

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