3-[(4-Aminophenyl)formamido]propanamide
Basic information
- CAS
1114822-89-7- Standard SMILES
NC(=O)CCNC(=O)c1ccc(N)cc1- InChIKey
IIYQQNHFDLLQMB-UHFFFAOYSA-N- Molecular formula
- C10H13N3O2
- Average molar mass
- 207.23 g/mol
- Monoisotopic mass
- 207.10077667
Names & identifiers
- Preferred name
- 3-[(4-Aminophenyl)formamido]propanamide
- IUPAC
- 4-amino-N-(3-amino-3-oxopropyl)benzamide
Names & synonyms
1114822-89-73-[(4-aminophenyl)formamido]propanamide4-amino-N-(3-amino-3-oxopropyl)benzamideDTXSID401261051PUB82289AKOS009476652EN300-88629Benzamide, 4-amino-N-(3-amino-3-oxopropyl)-G43647Z415735020
Database identifiers
- CAS
1114822-89-7- PubChem CID
- 39871995
- DTXSID
DTXSID401261051
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 98.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
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Compound notes
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