Basic information
- CAS
3563-92-6- Standard SMILES
CCN[C@H](Cc1ccccc1)[C@H]1CCCO1- InChIKey
DOFCLOLKFGSRTG-ZIAGYGMSSA-N- Molecular formula
- C14H21NO
- Average molar mass
- 219.32 g/mol
- Monoisotopic mass
- 219.16231429
Overview
Zylofuramine is a small molecule drug. Zylofuramine has a monoisotopic molecular weight of 219.16 Da.
Names & identifiers
- Preferred name
- 2-Furanmethanamine, N-ethyltetrahydro-alpha-(phenylmethyl)-, (R-(R*,R*))-
- IUPAC
- (1R)-N-ethyl-1-[(2R)-oxolan-2-yl]-2-phenylethanamine
- English name
- Zylofuramine
- Molecular formula
- C14H21NO
- Molecular weight
- 219.32
Names & synonyms
Zylofuramine3563-92-6ZilofuraminaZylofuraminum8N66VC535R2-Furanmethanamine, N-ethyltetrahydro-alpha-(phenylmethyl)-, (R-(R*,R*))-RefChem:1063233Zylofuramine [INN]ethyl[(1R)-1-[(2R)-oxolan-2-yl]-2-phenylethyl]amine(1R)-N-ethyl-1-[(2R)-oxolan-2-yl]-2-phenylethanamineD-threo-alpha-Benzyl-N-ethyltetrahydrofurfurylamineZylofuraminum [INN-Latin]
Show more names
(1R)-N-ethyl-1-[(2R)-oxolan-2-yl]-2-phenyl-ethanamineethyl-[(1R)-2-phenyl-1-[(2R)-tetrahydrofuran-2-yl]ethyl]amine2-Furanmethanamine, N-ethyltetrahydro-α-(phenylmethyl)-, [R-(R*,R*)]- (9CI)
Zilofuramina [INN-Spanish]BRN 1371229UNII-8N66VC535R5-18-09-00654 (Beilstein Handbook Reference)SCHEMBL161252CHEMBL3989838DTXSID20912313GLXC-06467
Database identifiers
- CAS
3563-92-6
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 189
Physicochemical properties
- Boiling point
- 328.8 · 328.8±15.0 °C(Predicted)
- Density
- 1.3277 · 1.3277 (rough estimate)
- refractive index
- 1.524 · 1.5240 (estimate)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 100 mg/mL · DMSO: ≥ 100 mg/mL (455.95 mM)
- form
- Solid
- pka
- 9.35 · 9.35±0.19(Predicted)
- color
- White to off-white
- FDA UNII
- 8 N66VC535R · 8N66VC535R
- Toxicity
- 50 oral · LD50 oral in mouse: 475mg/kg
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 oral in mouse: 475mg/kg
Chemistry & industry
Applications
UsesZylofuramine is a psychomotor stimulant[1].
Upstream & downstream products
Upstream raw materials
Suppliers11 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
台州川旭医药科技有限公司[email protected] 15165038510 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
ChemeGen 中国
Related reactions
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Compound notes
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