N-[2-(3-aminopyrrolidin-1-yl)-2-oxoethyl]-3-(trifluoromethyl)benzamide

N-[2-(3-aminopyrrolidin-1-yl)-2-oxoethyl]-3-(trifluoromethyl)benzamide

Formula: C14H16F3N3O2

SMILES: NC1CCN(C1)C(=O)CNC(=O)C1=CC(=CC=C1)C(F)(F)F

IUPAC: N-[2-(3-aminopyrrolidin-1-yl)-2-oxoethyl]-3-(trifluoromethyl)benzamide

InChI: InChI=1/C14H16F3N3O2/c15-14(16,17)10-3-1-2-9(6-10)13(22)19-7-12(21)20-5-4-11(18)8-20/h1-3,6,11H,4-5,7-8,18H2,(H,19,22)

Composition: C (53.33%), H (5.12%), F (18.08%), N (13.33%), O (10.15%)

Molar Mass: 315.296

Atom Count: 38

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	315.119461256
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	XNRHTENCTZKMOJ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.22
Topological Polar Surface Area	75.43
Polarizability	27.43
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C14H16F3N3O2		Quote Only