N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride

C11H18Cl2N4O — CID 154825632

IUPACN-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride
SMILESCC(=O)Nc1cncc(N2CCNCC2)c1.Cl.Cl
InChIInChI=1S/C11H16N4O.2ClH/c1-9(16)14-10-6-11(8-13-7-10)15-4-2-12-3-5-15;;/h6-8,12H,2-5H2,1H3,(H,14,16);2*1H
InChIKeyVYNXODFSDULEAI-UHFFFAOYSA-N
MW293.20 g/mol
LogP1.29
Rot. Bonds2

About N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride

N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride (PubChem CID 154825632) has the molecular formula C11H18Cl2N4O and a molecular weight of 293.20 g/mol. Its IUPAC name is N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride.

Molecular Properties

Compound NameN-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride
PubChem CID154825632
Molecular FormulaC11H18Cl2N4O
Molecular Weight293.20 g/mol
Exact Mass292.09
IUPAC NameN-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride
SMILESCC(=O)Nc1cncc(N2CCNCC2)c1.Cl.Cl
InChIInChI=1S/C11H16N4O.2ClH/c1-9(16)14-10-6-11(8-13-7-10)15-4-2-12-3-5-15;;/h6-8,12H,2-5H2,1H3,(H,14,16);2*1H
InChIKeyVYNXODFSDULEAI-UHFFFAOYSA-N
XLogP1.29
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.20
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-3-(3-methylpyrazol-1-yl)-N-(5-piperazin-1-yl-3-pyridinyl)propanamide
CID 167826169
1-(5-methoxy-3-pyridinyl)piperazine;dihydrochloride
CID 126809385
(E)-but-2-enedioic acid;1-(5-chloro-3-pyridinyl)piperazine
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N-(4-acetamidophenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225827
N-(4-acetamidophenyl)-5-(azepan-1-yl)pyridine-3-carboxamide
CID 109241376
5-piperazin-1-ylpyrimidine;hydrochloride
CID 69201469
1-[5-(trifluoromethyl)-3-pyridinyl]piperazine;dihydrochloride
CID 154825593
5-(1,4-diazepan-1-yl)pyridin-3-ol
CID 10559695
1-[4-[5-(methylamino)-3-pyridinyl]-1,4-diazepan-1-yl]ethanone
CID 104533805
2-methyl-N-(5-methyl-3-pyridinyl)-2-piperazin-1-ylpropanamide
CID 103814539
(E)-but-2-enedioic acid;1-(5-chloro-3-pyridinyl)-1,4-diazepane
CID 131725809
N-(3-fluoro-4-piperazin-1-ylphenyl)acetamide
CID 20785639

Frequently Asked Questions

What is the IUPAC name of N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride?
The IUPAC name of N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride (CID 154825632) is N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride.
What is the SMILES notation for N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride?
The canonical SMILES for N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride is CC(=O)Nc1cncc(N2CCNCC2)c1.Cl.Cl.
What is the InChIKey of N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride?
The InChIKey is VYNXODFSDULEAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O.2ClH/c1-9(16)14-10-6-11(8-13-7-10)15-4-2-12-3-5-15;;/h6-8,12H,2-5H2,1H3,(H,14,16);2*1H.
What are the key properties of N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride?
N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride has a molecular weight of 293.20 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-piperazin-1-yl-3-pyridinyl)acetamide;dihydrochloride is sourced from PubChem (CID 154825632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).