tert-butyl N-[(3S)-pyrrolidin-3-yl]carbamate

tert-butyl N-[(3S)-pyrrolidin-3-yl]carbamate

CAS: 122536-76-9

Formula: C9H18N2O2

SMILES: CC(C)(C)OC(=O)N[C@H]1CCNC1

IUPAC: tert-butyl N-[(3S)-pyrrolidin-3-yl]carbamate

InChI: InChI=1S/C9H18N2O2/c1-9(2,3)13-8(12)11-7-4-5-10-6-7/h7,10H,4-6H2,1-3H3,(H,11,12)/t7-/m0/s1

Composition: C (58.04%), H (9.74%), N (15.04%), O (17.18%)

Molar Mass: 186.255

Atom Count: 31

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	186.136827828
Formal Charge	0
FSP3	0.89
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	DQQJBEAXSOOCPG-ZETCQYMHSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.08
Topological Polar Surface Area	50.36
Polarizability	20.02
Ring Count	1
Rotatable Bond Count	3

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