Basic information
- CAS
429639-61-2- Standard SMILES
CCN(Cc1ccccc1)C(=O)C1CCNCC1- InChIKey
YGSADUQWAHCUDV-UHFFFAOYSA-N- Molecular formula
- C15H22N2O
- Average molar mass
- 246.35 g/mol
- Monoisotopic mass
- 246.17321333
Names & identifiers
- Preferred name
- N-benzyl-N-ethylpiperidine-4-carboxamide
- IUPAC
- N-benzyl-N-ethylpiperidine-4-carboxamide
- English name
- N-benzyl-N-ethylpiperidine-4-carboxamide
- Molecular formula
- C15H22N2O
- Molecular weight
- 246.35
Names & synonyms
N-benzyl-N-ethylpiperidine-4-carboxamide429639-61-2MFCD03137452Cambridge id 6578538SCHEMBL8791707CHEMBL4572323AKOS009257629SB43348BS-37879N-benzyl-N-ethyl-piperidine-4-carboxamideF315046N-Benzyl-N-ethylpiperidine-4-carboxamide, AldrichCPR
Show more names
UKRORGSYN-BB BBV-2421764-Piperidinecarboxamide, N-ethyl-N-(phenylmethyl)-N-benzyl-N-ethylpiperidine-4-carboxamide(SALTDATA: FREE)
Database identifiers
- CAS
429639-61-2- PubChem CID
- 412862
- DTXSID
DTXSID70328647- ChEMBL
CHEMBL4572323
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 255
Physicochemical properties
- form
- solid
- InChI
- 1S/C15H22N2O/c1-2-17(12-13-6-4-3-5-7-13)15(18)14-8-10-16-11-9-14/h3-7,14,16H,2,8-12H2,1H3
- InChIKey
- YGSADUQWAHCUDV-UHFFFAOYSA-N
- SMILES
- CCN(Cc1ccccc1)C(=O)C2CCNCC2
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 305 · P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36
- Safety Statements
- 26 · 26
- WGK Germany
- 3 · WGK 3
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 · Eye Irrit. 2
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
- wgk
- WGK 3
- risk_code
- 36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H319
- Hazard Classifications
- Eye Irrit. 2
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Suppliers3 total
Aladdin Scientific[email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…