N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide

C17H27N3O3S — CID 51686284

IUPACN-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide
SMILESCC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)CN2CCCCC2)cc1
InChIInChI=1S/C17H27N3O3S/c1-3-14(2)19-24(22,23)16-9-7-15(8-10-16)18-17(21)13-20-11-5-4-6-12-20/h7-10,14,19H,3-6,11-13H2,1-2H3,(H,18,21)/t14-/m1/s1
InChIKeySRJOHFXFFPXNBW-CQSZACIVSA-N
MW353.49 g/mol
LogP2.19
Rot. Bonds7

About N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide

N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide (PubChem CID 51686284) has the molecular formula C17H27N3O3S and a molecular weight of 353.49 g/mol. Its IUPAC name is N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide
PubChem CID51686284
Molecular FormulaC17H27N3O3S
Molecular Weight353.49 g/mol
Exact Mass353.18
IUPAC NameN-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide
SMILESCC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)CN2CCCCC2)cc1
InChIInChI=1S/C17H27N3O3S/c1-3-14(2)19-24(22,23)16-9-7-15(8-10-16)18-17(21)13-20-11-5-4-6-12-20/h7-10,14,19H,3-6,11-13H2,1-2H3,(H,18,21)/t14-/m1/s1
InChIKeySRJOHFXFFPXNBW-CQSZACIVSA-N
XLogP2.19
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[2-(azepan-1-yl)acetyl]amino]phenyl]-2-methylpropanamide
CID 54814594
2-(azepan-1-yl)-N-(4-sulfamoylphenyl)acetamide
CID 732235
N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]butanamide
CID 51566560
N-[4-(butan-2-ylsulfamoyl)phenyl]acetamide
CID 3113473
N-[4-[[2-(azepan-1-yl)acetyl]amino]phenyl]propanamide
CID 54814408
[2-[4-[[(2R)-butan-2-yl]sulfamoyl]anilino]-2-oxoethyl]-cycloheptylazanium
CID 7406873
3-methyl-N-[4-[(2-piperidin-1-ylacetyl)amino]phenyl]butanamide
CID 54815187
N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide
CID 8901829
2-(azepan-1-yl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide
CID 2104267
N-[4-[[(2S)-butan-2-yl]sulfamoyl]phenyl]-2-(cyclopentylamino)acetamide
CID 1460470
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-ethoxyacetamide
CID 4530095
N-[4-(butan-2-ylsulfamoyl)phenyl]-4-(propanoylamino)benzamide
CID 4209013

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide?
The IUPAC name of N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide (CID 51686284) is N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide?
The canonical SMILES for N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide is CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)CN2CCCCC2)cc1.
What is the InChIKey of N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide?
The InChIKey is SRJOHFXFFPXNBW-CQSZACIVSA-N. The full InChI is InChI=1S/C17H27N3O3S/c1-3-14(2)19-24(22,23)16-9-7-15(8-10-16)18-17(21)13-20-11-5-4-6-12-20/h7-10,14,19H,3-6,11-13H2,1-2H3,(H,18,21)/t14-/m1/s1.
What are the key properties of N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide?
N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide has a molecular weight of 353.49 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide is sourced from PubChem (CID 51686284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).