N-[(2S)-pyrrolidin-2-ylmethyl]aniline

N-[(2S)-pyrrolidin-2-ylmethyl]aniline

CAS: 64030-44-0

Formula: C11H16N2

SMILES: C(NC1=CC=CC=C1)[C@@H]1CCCN1

IUPAC: N-{[(2S)-pyrrolidin-2-yl]methyl}aniline

InChI: InChI=1S/C11H16N2/c1-2-5-10(6-3-1)13-9-11-7-4-8-12-11/h1-3,5-6,11-13H,4,7-9H2/t11-/m0/s1

Composition: C (74.96%), H (9.15%), N (15.89%)

Molar Mass: 176.263

Atom Count: 29

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	176.131348523
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	MCHWKJRTMPIHRA-NSHDSACASA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.19
Topological Polar Surface Area	24.06
Polarizability	21.51
Ring Count	2
Rotatable Bond Count	3

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