1-[5-(2-Carbamoylpyrrol-1-yl)naphthalen-1-yl]pyrrole-2-carboxamide
Basic information
- CAS
53413-91-5- Standard SMILES
NC(=O)c1cccn1-c1cccc2c(-n3cccc3C(N)=O)cccc12- InChIKey
KKPBUUJPUDLRON-UHFFFAOYSA-N- Molecular formula
- C20H16N4O2
- Average molar mass
- 344.4 g/mol
- Monoisotopic mass
- 344.12732577
Names & identifiers
- Preferred name
- 1-[5-(2-Carbamoylpyrrol-1-yl)naphthalen-1-yl]pyrrole-2-carboxamide
- IUPAC
- 1-[5-(2-carbamoylpyrrol-1-yl)naphthalen-1-yl]pyrrole-2-carboxamide
Names & synonyms
53413-91-5NSC2095201-[5-(2-carbamoylpyrrol-1-yl)naphthalen-1-yl]pyrrole-2-carboxamideDTXSID90308805NSC-209520DS-0030351,1'-(Naphthalene-1,5-diyl)di(1H-pyrrole-2-carboxamide)1H-pyrrole-2-carboxamide,1,1-(1,5-naphthalenediyl)bis-
Database identifiers
- CAS
53413-91-5- PubChem CID
- 308334
- DTXSID
DTXSID90308805
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 506
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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