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Structure

4-(3-Amino-propyl)-piperazin-2-one

CAS
917562-07-3
Catalog Number
ACM917562073
Category
Other Products
Molecular Weight
157.21
Molecular Formula
C7H15N3O

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Specification

Synonyms
4-(3-AMINO-PROPYL)-PIPERAZIN-2-ONE
What is the molecular formula of the compound 4-(3-Amino-propyl)-piperazin-2-one?

The molecular formula is C7H15N3O.

What is the computed molecular weight of the compound?

The computed molecular weight is 157.21 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 4-(3-aminopropyl)piperazin-2-one.

What is the Canonical SMILES of the compound?

The Canonical SMILES is C1CN(CC(=O)N1)CCCN.

What is the InChIKey of the compound?

The InChIKey is RRUDNGHRYYEPSK-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in the compound?

There are 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in the compound?

There are 3 hydrogen bond acceptor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 58.4 Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the complexity of the compound?

The complexity is 138.

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