tert-butyl N-benzyl-N-{2-[methoxy(methyl)carbamoyl]ethyl}carbamate

tert-butyl N-benzyl-N-{2-[methoxy(methyl)carbamoyl]ethyl}carbamate

CAS: 1222789-82-3

Formula: C17H26N2O4

SMILES: CON(C)C(=O)CCN(CC1=CC=CC=C1)C(=O)OC(C)(C)C

IUPAC: tert-butyl N-benzyl-N-{2-[methoxy(methyl)carbamoyl]ethyl}carbamate

InChI: InChI=1S/C17H26N2O4/c1-17(2,3)23-16(21)19(12-11-15(20)18(4)22-5)13-14-9-7-6-8-10-14/h6-10H,11-13H2,1-5H3

Composition: C (63.33%), H (8.13%), N (8.69%), O (19.85%)

Molar Mass: 322.405

Atom Count: 49

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	322.189257325
Formal Charge	0
FSP3	0.53
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	OXAZUFSUQINPCN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.05
Topological Polar Surface Area	59.08
Polarizability	34.4
Ring Count	1
Rotatable Bond Count	8

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