N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride

C12H24ClN3O — CID 6917681

IUPACN-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride
SMILESCl.O=C(CN1CCNCC1)NC1CCCCC1
InChIInChI=1S/C12H23N3O.ClH/c16-12(10-15-8-6-13-7-9-15)14-11-4-2-1-3-5-11;/h11,13H,1-10H2,(H,14,16);1H
InChIKeyNJIZIJFDFPHEQU-UHFFFAOYSA-N
MW261.80 g/mol
LogP0.76
Rot. Bonds3

About N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride

N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride (PubChem CID 6917681) has the molecular formula C12H24ClN3O and a molecular weight of 261.80 g/mol. Its IUPAC name is N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride
PubChem CID6917681
Molecular FormulaC12H24ClN3O
Molecular Weight261.80 g/mol
Exact Mass261.16
IUPAC NameN-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride
SMILESCl.O=C(CN1CCNCC1)NC1CCCCC1
InChIInChI=1S/C12H23N3O.ClH/c16-12(10-15-8-6-13-7-9-15)14-11-4-2-1-3-5-11;/h11,13H,1-10H2,(H,14,16);1H
InChIKeyNJIZIJFDFPHEQU-UHFFFAOYSA-N
XLogP0.76
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.80
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride?
The IUPAC name of N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride (CID 6917681) is N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride.
What is the SMILES notation for N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride?
The canonical SMILES for N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride is Cl.O=C(CN1CCNCC1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride?
The InChIKey is NJIZIJFDFPHEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O.ClH/c16-12(10-15-8-6-13-7-9-15)14-11-4-2-1-3-5-11;/h11,13H,1-10H2,(H,14,16);1H.
What are the key properties of N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride?
N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride has a molecular weight of 261.80 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-piperazin-1-ylacetamide;hydrochloride is sourced from PubChem (CID 6917681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).