2-(4-tert-butylpiperazin-1-yl)acetamide

C10H21N3O — CID 21029381

IUPAC2-(4-tert-butylpiperazin-1-yl)acetamide
SMILESCC(C)(C)N1CCN(CC(N)=O)CC1
InChIInChI=1S/C10H21N3O/c1-10(2,3)13-6-4-12(5-7-13)8-9(11)14/h4-8H2,1-3H3,(H2,11,14)
InChIKeyOQKNYIJQGAOBFU-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.11
Rot. Bonds2

About 2-(4-tert-butylpiperazin-1-yl)acetamide

2-(4-tert-butylpiperazin-1-yl)acetamide (PubChem CID 21029381) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-(4-tert-butylpiperazin-1-yl)acetamide.

Molecular Properties

Compound Name2-(4-tert-butylpiperazin-1-yl)acetamide
PubChem CID21029381
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-(4-tert-butylpiperazin-1-yl)acetamide
SMILESCC(C)(C)N1CCN(CC(N)=O)CC1
InChIInChI=1S/C10H21N3O/c1-10(2,3)13-6-4-12(5-7-13)8-9(11)14/h4-8H2,1-3H3,(H2,11,14)
InChIKeyOQKNYIJQGAOBFU-UHFFFAOYSA-N
XLogP-0.11
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylpiperazin-1-yl)acetamide?
The IUPAC name of 2-(4-tert-butylpiperazin-1-yl)acetamide (CID 21029381) is 2-(4-tert-butylpiperazin-1-yl)acetamide.
What is the SMILES notation for 2-(4-tert-butylpiperazin-1-yl)acetamide?
The canonical SMILES for 2-(4-tert-butylpiperazin-1-yl)acetamide is CC(C)(C)N1CCN(CC(N)=O)CC1.
What is the InChIKey of 2-(4-tert-butylpiperazin-1-yl)acetamide?
The InChIKey is OQKNYIJQGAOBFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-10(2,3)13-6-4-12(5-7-13)8-9(11)14/h4-8H2,1-3H3,(H2,11,14).
What are the key properties of 2-(4-tert-butylpiperazin-1-yl)acetamide?
2-(4-tert-butylpiperazin-1-yl)acetamide has a molecular weight of 199.30 g/mol, XLogP of -0.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylpiperazin-1-yl)acetamide is sourced from PubChem (CID 21029381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).