5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)-N-(prop-2-en-1-yl)pentanimidic acid
Basic information
- CAS
14722-18-0- Standard SMILES
C=CCNC(=O)C(CCCN(C)C)(c1cccc2ccccc12)C(C)C- InChIKey
JALFMLDOAVDPIC-UHFFFAOYSA-N- Molecular formula
- C23H32N2O
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.25146365
Names & identifiers
- Preferred name
- 5-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)-N-(prop-2-en-1-yl)pentanimidic acid
- IUPAC
- 5-(dimethylamino)-2-naphthalen-1-yl-2-propan-2-yl-N-prop-2-enylpentanamide
- English name
- N-Allyl-α-[3-(dimethylamino)propyl]-α-isopropyl-1-naphthaleneacetamide
- Molecular formula
- C23H32N2O
- Molecular weight
- 352.51
Names & synonyms
14722-18-0DTXSID909330705-(Dimethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)-N-(prop-2-en-1-yl)pentanimidic acidRefChem:1072526DTXCID201361742N-Allyl-alpha-(3-(dimethylamino)propyl)-alpha-isopropyl-1-naphthaleneacetamide5-(dimethylamino)-2-naphthalen-1-yl-2-propan-2-yl-N-prop-2-enylpentanamideN-Allyl-alpha-[3-(dimethylamino)propyl]-alpha-isopropyl-1-naphthaleneacetamideBRN 27709491-Naphthaleneacetamide, N-allyl-alpha-(3-(dimethylamino)propyl)-alpha-isopropyl-N-Allyl-α-[3-(dimethylamino)propyl]-α-isopropyl-1-naphthaleneacetamide1-Naphthaleneacetamide, α-[3-(dimethylamino)propyl]-α-(1-methylethyl)-N-2-propen-1-yl-
Database identifiers
- CAS
14722-18-0- PubChem CID
- 203597
- DTXSID
DTXSID90933070- Nikkaji
- J42.359I
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 459
Physicochemical properties
- Boiling point
- 532.3 · 532.3±50.0 °C(Predicted)
- Density
- 1.014 · 1.014±0.06 g/cm3(Predicted)
- pka
- 15.4 · 15.40±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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