2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride

C15H25ClN4O3S — CID 120620773

IUPAC2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride
SMILESCCCS(=O)(=O)N1CCC(NC(=O)Cc2ccc(N)cn2)CC1.Cl
InChIInChI=1S/C15H24N4O3S.ClH/c1-2-9-23(21,22)19-7-5-13(6-8-19)18-15(20)10-14-4-3-12(16)11-17-14;/h3-4,11,13H,2,5-10,16H2,1H3,(H,18,20);1H
InChIKeyZADURWCRSARDIB-UHFFFAOYSA-N
MW376.91 g/mol
LogP0.95
Rot. Bonds6

About 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride (PubChem CID 120620773) has the molecular formula C15H25ClN4O3S and a molecular weight of 376.91 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride
PubChem CID120620773
Molecular FormulaC15H25ClN4O3S
Molecular Weight376.91 g/mol
Exact Mass376.13
IUPAC Name2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride
SMILESCCCS(=O)(=O)N1CCC(NC(=O)Cc2ccc(N)cn2)CC1.Cl
InChIInChI=1S/C15H24N4O3S.ClH/c1-2-9-23(21,22)19-7-5-13(6-8-19)18-15(20)10-14-4-3-12(16)11-17-14;/h3-4,11,13H,2,5-10,16H2,1H3,(H,18,20);1H
InChIKeyZADURWCRSARDIB-UHFFFAOYSA-N
XLogP0.95
TPSA105.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.91
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
CID 120633539
2-(5-amino-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 107337839
2-(4-aminophenyl)-N-(1-ethylsulfonylpiperidin-4-yl)acetamide;hydrochloride
CID 119702884
2-(5-amino-2-pyridinyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide;dihydrochloride
CID 120643499
2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
CID 120618487
2-chloro-N-(1-propylsulfonylpiperidin-4-yl)acetamide
CID 43425928
2-(5-amino-2-pyridinyl)-N-cyclohex-3-en-1-ylacetamide
CID 107339064
2-(5-amino-2-pyridinyl)-N-(oxolan-3-yl)acetamide
CID 107339286
2-(5-amino-2-pyridinyl)-N-(thiolan-3-yl)acetamide
CID 107339832
3-(aminomethyl)-N-(1-propylsulfonylpiperidin-4-yl)pentanamide
CID 81071434
2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride
CID 120633899
4-oxo-4-[(1-propylsulfonylpiperidin-4-yl)amino]butanoic acid
CID 60940483

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride (CID 120620773) is 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride is CCCS(=O)(=O)N1CCC(NC(=O)Cc2ccc(N)cn2)CC1.Cl.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride?
The InChIKey is ZADURWCRSARDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S.ClH/c1-2-9-23(21,22)19-7-5-13(6-8-19)18-15(20)10-14-4-3-12(16)11-17-14;/h3-4,11,13H,2,5-10,16H2,1H3,(H,18,20);1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride has a molecular weight of 376.91 g/mol, XLogP of 0.95, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride is sourced from PubChem (CID 120620773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).