trans-4-[(Boc-amino)methyl]-N-methoxy-N-methylcyclohexanecarboxamide - CAS 248953-91-5
Catalog: |
BB018655 |
Product Name: |
trans-4-[(Boc-amino)methyl]-N-methoxy-N-methylcyclohexanecarboxamide |
CAS: |
248953-91-5 |
Synonyms: |
N-[[4-[[methoxy(methyl)amino]-oxomethyl]cyclohexyl]methyl]carbamic acid tert-butyl ester; tert-butyl N-[[4-[methoxy(methyl)carbamoyl]cyclohexyl]methyl]carbamate |
IUPAC Name: | tert-butyl N-[[4-[methoxy(methyl)carbamoyl]cyclohexyl]methyl]carbamate |
Description: | trans-4-[(Boc-amino)methyl]-N-methoxy-N-methylcyclohexanecarboxamide (CAS# 248953-91-5 ) is a useful research chemical. |
Molecular Weight: | 300.39 |
Molecular Formula: | C15H28N2O4 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)N(C)OC |
InChI: | InChI=1S/C15H28N2O4/c1-15(2,3)21-14(19)16-10-11-6-8-12(9-7-11)13(18)17(4)20-5/h11-12H,6-10H2,1-5H3,(H,16,19) |
InChI Key: | SCEZZNUUAXWOBM-UHFFFAOYSA-N |
LogP: | 2.72820 |
Publication Number | Title | Priority Date |
US-2007213376-A1 | Halogenated sulfonamide derivatives | 20060307 |
CA-2613377-A1 | Alkyl sulfonamide derivatives | 20050623 |
JP-2008546787-A | Alkylsulfonamide derivatives | 20050623 |
KR-20080018206-A | Alkyl sulfonamide derivatives | 20050623 |
US-2006293341-A1 | Alkyl sulfonamide derivatives | 20050623 |
Complexity: | 357 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 300.20490738 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 300.20490738 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 67.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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