N-(7-{[1-(morpholine-4-carbonyl)-piperidin-4-ylmethyl]-propyl-amino}-5,6,7,8-tetrahydro-naphthalen-2-yl)-isobutyramide
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Basic information
- Standard SMILES
CCCN(CC1CCN(C(=O)N2CCOCC2)CC1)C1CCc2ccc(NC(=O)C(C)C)cc2C1- InChIKey
IFIKJFSEPHUNKY-UHFFFAOYSA-N- Molecular formula
- C28H44N4O3
- Average molar mass
- 484.7 g/mol
- Monoisotopic mass
- 484.34134128
Names & identifiers
- Preferred name
- N-(7-{[1-(morpholine-4-carbonyl)-piperidin-4-ylmethyl]-propyl-amino}-5,6,7,8-tetrahydro-naphthalen-2-yl)-isobutyramide
- IUPAC
- 2-methyl-N-[7-[[1-(morpholine-4-carbonyl)piperidin-4-yl]methyl-propylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]propanamide
Names & synonyms
SCHEMBL3389066IFIKJFSEPHUNKY-UHFFFAOYSA-NN-(7-{[1-(morpholine-4-carbonyl)-piperidin-4-ylmethyl]-propyl-amino}-5,6,7,8-tetrahydro-naphthalen-2-yl)-isobutyramide
Database identifiers
- PubChem CID
- 21362785
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 688
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Related reactions
3 records
Compound notes
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