2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride

C10H22ClN3O3S — CID 120575937

IUPAC2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
SMILESCC1NCCCC1NC(=O)CN(C)S(C)(=O)=O.Cl
InChIInChI=1S/C10H21N3O3S.ClH/c1-8-9(5-4-6-11-8)12-10(14)7-13(2)17(3,15)16;/h8-9,11H,4-7H2,1-3H3,(H,12,14);1H
InChIKeyJXSIXYAHFWRUBO-UHFFFAOYSA-N
MW299.82 g/mol
LogP-0.44
Rot. Bonds4

About 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride

2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride (PubChem CID 120575937) has the molecular formula C10H22ClN3O3S and a molecular weight of 299.82 g/mol. Its IUPAC name is 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
PubChem CID120575937
Molecular FormulaC10H22ClN3O3S
Molecular Weight299.82 g/mol
Exact Mass299.11
IUPAC Name2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
SMILESCC1NCCCC1NC(=O)CN(C)S(C)(=O)=O.Cl
InChIInChI=1S/C10H21N3O3S.ClH/c1-8-9(5-4-6-11-8)12-10(14)7-13(2)17(3,15)16;/h8-9,11H,4-7H2,1-3H3,(H,12,14);1H
InChIKeyJXSIXYAHFWRUBO-UHFFFAOYSA-N
XLogP-0.44
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.82
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-2-[methyl(methylsulfonyl)amino]acetamide;hydrochloride
CID 119611051
1,1-dimethyl-3-[(2R,3R)-2-methylpiperidin-3-yl]urea
CID 118114950
N-(2-methylpiperidin-3-yl)-2-propylsulfonylacetamide
CID 120577111
3,3-dimethyl-N-(2-methylpiperidin-3-yl)butanamide
CID 79042098
N-(2-methylpiperidin-3-yl)-2-pentylsulfonylacetamide;hydrochloride
CID 120577037
2-[(4-methylcyclohexyl)sulfamoyl]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120575817
N-[(2S,3S)-2-methylpiperidin-3-yl]but-3-enamide
CID 130763417
N-(2-methylpiperidin-3-yl)-2-phenylacetamide;hydrochloride
CID 120574528
2-(methanesulfonamido)-N-(2-methylpiperidin-3-yl)propanamide;hydrochloride
CID 120575422
N-(2-methylpiperidin-3-yl)-2-(trifluoromethylsulfanyl)acetamide;hydrochloride
CID 120574102
N-(2-methylpiperidin-3-yl)-2-propan-2-yloxyacetamide
CID 112602527
2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120576176

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The IUPAC name of 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride (CID 120575937) is 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The canonical SMILES for 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride is CC1NCCCC1NC(=O)CN(C)S(C)(=O)=O.Cl.
What is the InChIKey of 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The InChIKey is JXSIXYAHFWRUBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3S.ClH/c1-8-9(5-4-6-11-8)12-10(14)7-13(2)17(3,15)16;/h8-9,11H,4-7H2,1-3H3,(H,12,14);1H.
What are the key properties of 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride has a molecular weight of 299.82 g/mol, XLogP of -0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 120575937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).