4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-carbonyl)aniline

4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-carbonyl)aniline

CAS: 878658-52-7

Formula: C15H21N3O

SMILES: NC1=CC(C(=O)N2CCCC2)=C(C=C1)N1CCCC1

IUPAC: 4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-carbonyl)aniline

InChI: InChI=1S/C15H21N3O/c16-12-5-6-14(17-7-1-2-8-17)13(11-12)15(19)18-9-3-4-10-18/h5-6,11H,1-4,7-10,16H2

Composition: C (69.47%), H (8.16%), N (16.20%), O (6.17%)

Molar Mass: 259.353

Atom Count: 40

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	259.168462308
Formal Charge	0
FSP3	0.53
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XHJQQXUYBFPESV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.14
Topological Polar Surface Area	49.57
Polarizability	28.71
Ring Count	3
Rotatable Bond Count	2

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