N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide

C11H21N3O — CID 43600320

IUPACN-(2-piperazin-1-ylethyl)cyclobutanecarboxamide
SMILESO=C(NCCN1CCNCC1)C1CCC1
InChIInChI=1S/C11H21N3O/c15-11(10-2-1-3-10)13-6-9-14-7-4-12-5-8-14/h10,12H,1-9H2,(H,13,15)
InChIKeyJEMAAFAEQNSYAF-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.19
Rot. Bonds4

About N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide

N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide (PubChem CID 43600320) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(2-piperazin-1-ylethyl)cyclobutanecarboxamide
PubChem CID43600320
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-(2-piperazin-1-ylethyl)cyclobutanecarboxamide
SMILESO=C(NCCN1CCNCC1)C1CCC1
InChIInChI=1S/C11H21N3O/c15-11(10-2-1-3-10)13-6-9-14-7-4-12-5-8-14/h10,12H,1-9H2,(H,13,15)
InChIKeyJEMAAFAEQNSYAF-UHFFFAOYSA-N
XLogP-0.19
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
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-(2-piperazin-1-ylethyl)cyclobutanecarboxamide?
The IUPAC name of N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide (CID 43600320) is N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide.
What is the SMILES notation for N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide?
The canonical SMILES for N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide is O=C(NCCN1CCNCC1)C1CCC1.
What is the InChIKey of N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide?
The InChIKey is JEMAAFAEQNSYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c15-11(10-2-1-3-10)13-6-9-14-7-4-12-5-8-14/h10,12H,1-9H2,(H,13,15).
What are the key properties of N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide?
N-(2-piperazin-1-ylethyl)cyclobutanecarboxamide has a molecular weight of 211.31 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-(2-piperazin-1-ylethyl)cyclobutanecarboxamide is sourced from PubChem (CID 43600320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).