Basic information
- CAS
17795-81-2- Standard SMILES
CCCCCC(=O)Nc1cccc(OC(=O)NC)c1C- InChIKey
RHNZNAMGDKZKCX-UHFFFAOYSA-N- Molecular formula
- C15H22N2O3
- Average molar mass
- 278.35 g/mol
- Monoisotopic mass
- 278.16304257
Names & identifiers
- Preferred name
- Hexananilide, 3'-hydroxy-2-methyl-, methylcarbamate (ester)
- IUPAC
- [3-(hexanoylamino)-2-methylphenyl] N-methylcarbamate
- English name
- N-Methylcarbamic acid 3-[(2-methylhexanoyl)amino]phenyl ester
- Molecular formula
- C15H22N2O3
- Molecular weight
- 278.35
Names & synonyms
m-(2-Methylhexanamido)phenyl methylcarbamateBRN 2143516DTXSID50170404RefChem:347601DTXCID809289517795-81-2Hexananilide, 3'-hydroxy-2-methyl-, methylcarbamate (ester)3-Hexanamido-2-methylphenyl methylcarbamateN-Methylcarbamic acid 3-[(2-methylhexanoyl)amino]phenyl esterHexanamide, 2-methyl-N-[3-[[(methylamino)carbonyl]oxy]phenyl]-
Database identifiers
- CAS
17795-81-2- PubChem CID
- 28776
- DTXSID
DTXSID50170404
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 320
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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