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3-(azepan-1-yl)-N-(2-methylphenyl)propanamide

3-(azepan-1-yl)-N-(2-methylphenyl)propanamide

Formula: C16H24N2O

SMILES: CC1=CC=CC=C1NC(=O)CCN1CCCCCC1

IUPAC: 3-(azepan-1-yl)-N-(2-methylphenyl)propanamide

InChI: InChI=1S/C16H24N2O/c1-14-8-4-5-9-15(14)17-16(19)10-13-18-11-6-2-3-7-12-18/h4-5,8-9H,2-3,6-7,10-13H2,1H3,(H,17,19)

Composition: C (73.81%), H (9.29%), N (10.76%), O (6.14%)

Molar Mass: 260.381

Atom Count: 43

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 260.188863401
Formal Charge 0
FSP3 0.56
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CTPREXNQGVNSHE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.83
Topological Polar Surface Area 32.34
Polarizability 30.67
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H24N2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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