tert-butyl 3-(cyclohexylamino)propanoate

tert-butyl 3-(cyclohexylamino)propanoate

CAS: 66937-56-2

Formula: C13H25NO2

SMILES: CC(C)(C)OC(=O)CCNC1CCCCC1

IUPAC: tert-butyl 3-(cyclohexylamino)propanoate

InChI: InChI=1S/C13H25NO2/c1-13(2,3)16-12(15)9-10-14-11-7-5-4-6-8-11/h11,14H,4-10H2,1-3H3

Composition: C (68.68%), H (11.08%), N (6.16%), O (14.07%)

Molar Mass: 227.348

Atom Count: 41

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	227.188529049
Formal Charge	0
FSP3	0.92
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YHEGEGRJAGMVKA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.07
Topological Polar Surface Area	38.33
Polarizability	26.23
Ring Count	1
Rotatable Bond Count	6

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