917562-04-0 Purity
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Specification
The molecular formula is C7H15N3O.
The computed molecular weight is 157.21 g/mol.
The IUPAC name is 4-(3-aminopropyl)piperazin-2-one.
The Canonical SMILES is C1CN(CC(=O)N1)CCCN.
The InChIKey is RRUDNGHRYYEPSK-UHFFFAOYSA-N.
There are 2 hydrogen bond donor counts.
There are 3 hydrogen bond acceptor counts.
The topological polar surface area is 58.4 Ų.
Yes, the compound is canonicalized.
The complexity is 138.
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