N,N-dimethylcarbamic acid 2,3-dihydro-1,3,3-trimethylindol-5-yl ester
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Basic information
- CAS
80589-35-1- Standard SMILES
CN(C)C(=O)Oc1ccc2c(c1)C(C)(C)CN2C- InChIKey
GNYIEGQLQKDVLM-UHFFFAOYSA-N- Molecular formula
- C14H20N2O2
- Average molar mass
- 248.32 g/mol
- Monoisotopic mass
- 248.15247789
Overview
structure given in first source
Names & identifiers
- Preferred name
- N,N-dimethylcarbamic acid 2,3-dihydro-1,3,3-trimethylindol-5-yl ester
- IUPAC
- (1,3,3-trimethyl-2H-indol-5-yl) N,N-dimethylcarbamate
- English name
- N,N-dimethylcarbamic acid 2,3-dihydro-1,3,3-trimethylindol-5-yl ester
- Molecular formula
- C14H20N2O2
- Molecular weight
- 248.32
Names & synonyms
80589-35-1N,N-Dimethylcarbamic acid 2,3-dihydro-1,3,3-trimethylindol-5-yl esterDTXSID70230413RefChem:161285DTXCID701529041,3,3-Trimethylindolin-5-yl dimethylcarbamateTMDMC(1,3,3-trimethyl-2H-indol-5-yl) N,N-dimethylcarbamateCarbamic acid, dimethyl-, 2,3-dihydro-1,3,3-trimethyl-1H-indol-5-yl esterSCHEMBL62649431,3,3-Trimethyl-2,3-dihydro-1H-indol-5-yl dimethylcarbamateCarbamic acid, dimethyl-, 2,3-dihydro-1,3,3-trimethyl-1H-indol-5-yl ester (9CI)
Database identifiers
- CAS
80589-35-1- PubChem CID
- 132201
- DTXSID
DTXSID70230413
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 328
Related reactions
0 records
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Compound notes
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