2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride

C11H17ClN4O — CID 156595313

IUPAC2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride
SMILESCl.O=C(CN1CCNCC1)Nc1cccnc1
InChIInChI=1S/C11H16N4O.ClH/c16-11(9-15-6-4-12-5-7-15)14-10-2-1-3-13-8-10;/h1-3,8,12H,4-7,9H2,(H,14,16);1H
InChIKeyRHSHLAPILKMDMX-UHFFFAOYSA-N
MW256.74 g/mol
LogP0.35
Rot. Bonds3

About 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride

2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride (PubChem CID 156595313) has the molecular formula C11H17ClN4O and a molecular weight of 256.74 g/mol. Its IUPAC name is 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride.

Molecular Properties

Compound Name2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride
PubChem CID156595313
Molecular FormulaC11H17ClN4O
Molecular Weight256.74 g/mol
Exact Mass256.11
IUPAC Name2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride
SMILESCl.O=C(CN1CCNCC1)Nc1cccnc1
InChIInChI=1S/C11H16N4O.ClH/c16-11(9-15-6-4-12-5-7-15)14-10-2-1-3-13-8-10;/h1-3,8,12H,4-7,9H2,(H,14,16);1H
InChIKeyRHSHLAPILKMDMX-UHFFFAOYSA-N
XLogP0.35
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-morpholin-4-yl-N-pyridin-3-ylacetamide
CID 124786353
2-(4,4-dimethylpiperidin-1-yl)-N-pyridin-3-ylacetamide
CID 90951013
N-(4-hydroxyphenyl)-2-piperazin-1-ylacetamide
CID 60850914
2-[4-(oxane-4-carbonyl)piperazin-1-yl]-N-pyridin-3-ylacetamide
CID 74244540
N-(1-methylpyrazol-4-yl)-2-piperazin-1-ylacetamide
CID 43535278
2-(1,4-diazepan-1-yl)-N-(4-phenylphenyl)acetamide;hydrochloride
CID 119906439
N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide
CID 115377065
2-piperazin-1-yl-N-[3-(1,2,4-triazol-4-yl)phenyl]acetamide
CID 60851422
1-methyl-5-(piperazin-1-ylmethyl)-N-pyridin-3-ylpyrazole-4-carboxamide
CID 83580921
N-(3,4-dimethylphenyl)-2-piperazin-1-ylacetamide;hydrochloride
CID 132965081
2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide
CID 90560854
2-[4-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperazin-1-yl]-N-pyridin-3-ylacetamide
CID 90561328

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride?
The IUPAC name of 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride (CID 156595313) is 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride.
What is the SMILES notation for 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride?
The canonical SMILES for 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride is Cl.O=C(CN1CCNCC1)Nc1cccnc1.
What is the InChIKey of 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride?
The InChIKey is RHSHLAPILKMDMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O.ClH/c16-11(9-15-6-4-12-5-7-15)14-10-2-1-3-13-8-10;/h1-3,8,12H,4-7,9H2,(H,14,16);1H.
What are the key properties of 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride?
2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride has a molecular weight of 256.74 g/mol, XLogP of 0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride is sourced from PubChem (CID 156595313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).