N-[(2S)-3-methyl-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-3-phenylpropanamide

N-[(2S)-3-methyl-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-3-phenylpropanamide

CAS: 566914-00-9

Formula: C18H26N2O2

SMILES: CC(C)[C@H](NC(=O)CCC1=CC=CC=C1)C(=O)N1CCCC1

IUPAC: N-[(2S)-3-methyl-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-3-phenylpropanamide

InChI: InChI=1S/C18H26N2O2/c1-14(2)17(18(22)20-12-6-7-13-20)19-16(21)11-10-15-8-4-3-5-9-15/h3-5,8-9,14,17H,6-7,10-13H2,1-2H3,(H,19,21)/t17-/m0/s1

Composition: C (71.49%), H (8.67%), N (9.26%), O (10.58%)

Molar Mass: 302.418

Atom Count: 48

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	302.199428085
Formal Charge	0
FSP3	0.56
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DAZSWUUAFHBCGE-KRWDZBQOSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.42
Topological Polar Surface Area	49.41
Polarizability	34.11
Ring Count	2
Rotatable Bond Count	6

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	566914-00-9		$32.87-$2,286.32$32.87$376.85$564.13$1,015.89$2,286.32