N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide

C13H27N3O4S — CID 120573960

IUPACN-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
SMILESCC(C)OCCS(=O)(=O)NCC(=O)NC1CCCNC1C
InChIInChI=1S/C13H27N3O4S/c1-10(2)20-7-8-21(18,19)15-9-13(17)16-12-5-4-6-14-11(12)3/h10-12,14-15H,4-9H2,1-3H3,(H,16,17)
InChIKeyGVKZZWMNQTYXDI-UHFFFAOYSA-N
MW321.44 g/mol
LogP-0.41
Rot. Bonds8

About N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide

N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide (PubChem CID 120573960) has the molecular formula C13H27N3O4S and a molecular weight of 321.44 g/mol. Its IUPAC name is N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide.

Molecular Properties

Compound NameN-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
PubChem CID120573960
Molecular FormulaC13H27N3O4S
Molecular Weight321.44 g/mol
Exact Mass321.17
IUPAC NameN-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
SMILESCC(C)OCCS(=O)(=O)NCC(=O)NC1CCCNC1C
InChIInChI=1S/C13H27N3O4S/c1-10(2)20-7-8-21(18,19)15-9-13(17)16-12-5-4-6-14-11(12)3/h10-12,14-15H,4-9H2,1-3H3,(H,16,17)
InChIKeyGVKZZWMNQTYXDI-UHFFFAOYSA-N
XLogP-0.41
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.44
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylpiperidin-4-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
CID 120598489
N-(2-methylpiperidin-3-yl)-2-propan-2-yloxyacetamide
CID 112602527
4-[[2-(2-propan-2-yloxyethylsulfonylamino)acetyl]amino]cyclohexane-1-carboxylic acid
CID 119229868
N-(2-methylpiperidin-3-yl)-2-propylsulfonylacetamide
CID 120577111
N-(piperidin-2-ylmethyl)-2-propan-2-yloxyethanesulfonamide
CID 79593606
3,3-dimethyl-N-(2-methylpiperidin-3-yl)butanamide
CID 79042098
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
CID 119572623
2-methyl-N-[(2R,3R)-2-methylpiperidin-3-yl]butanamide
CID 130763419
methyl 2-[(2-methylpiperidin-3-yl)sulfamoyl]propanoate
CID 114695160
2-[methyl(methylsulfonyl)amino]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120575937
2-cyclohexyl-N-[2-[(2-methylpiperidin-3-yl)amino]-2-oxoethyl]acetamide
CID 120577076
5-methoxy-N-(2-methylpiperidin-3-yl)pentanamide;hydrochloride
CID 120575880

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide?
The IUPAC name of N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide (CID 120573960) is N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide.
What is the SMILES notation for N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide?
The canonical SMILES for N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide is CC(C)OCCS(=O)(=O)NCC(=O)NC1CCCNC1C.
What is the InChIKey of N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide?
The InChIKey is GVKZZWMNQTYXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O4S/c1-10(2)20-7-8-21(18,19)15-9-13(17)16-12-5-4-6-14-11(12)3/h10-12,14-15H,4-9H2,1-3H3,(H,16,17).
What are the key properties of N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide?
N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide has a molecular weight of 321.44 g/mol, XLogP of -0.41, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-3-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide is sourced from PubChem (CID 120573960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).