N-butan-2-yl-2-piperazin-1-ylacetamide

C10H21N3O — CID 13289375

IUPACN-butan-2-yl-2-piperazin-1-ylacetamide
SMILESCCC(C)NC(=O)CN1CCNCC1
InChIInChI=1S/C10H21N3O/c1-3-9(2)12-10(14)8-13-6-4-11-5-7-13/h9,11H,3-8H2,1-2H3,(H,12,14)
InChIKeyLBYYAPDSZMMRDD-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.19
Rot. Bonds4

About N-butan-2-yl-2-piperazin-1-ylacetamide

N-butan-2-yl-2-piperazin-1-ylacetamide (PubChem CID 13289375) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N-butan-2-yl-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-piperazin-1-ylacetamide
PubChem CID13289375
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN-butan-2-yl-2-piperazin-1-ylacetamide
SMILESCCC(C)NC(=O)CN1CCNCC1
InChIInChI=1S/C10H21N3O/c1-3-9(2)12-10(14)8-13-6-4-11-5-7-13/h9,11H,3-8H2,1-2H3,(H,12,14)
InChIKeyLBYYAPDSZMMRDD-UHFFFAOYSA-N
XLogP-0.19
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-piperazin-1-ylacetamide?
The IUPAC name of N-butan-2-yl-2-piperazin-1-ylacetamide (CID 13289375) is N-butan-2-yl-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-butan-2-yl-2-piperazin-1-ylacetamide?
The canonical SMILES for N-butan-2-yl-2-piperazin-1-ylacetamide is CCC(C)NC(=O)CN1CCNCC1.
What is the InChIKey of N-butan-2-yl-2-piperazin-1-ylacetamide?
The InChIKey is LBYYAPDSZMMRDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-3-9(2)12-10(14)8-13-6-4-11-5-7-13/h9,11H,3-8H2,1-2H3,(H,12,14).
What are the key properties of N-butan-2-yl-2-piperazin-1-ylacetamide?
N-butan-2-yl-2-piperazin-1-ylacetamide has a molecular weight of 199.30 g/mol, XLogP of -0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-piperazin-1-ylacetamide is sourced from PubChem (CID 13289375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).