N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide

C18H29N3O3S — CID 2681860

IUPACN-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](C)C2)cc1
InChIInChI=1S/C18H29N3O3S/c1-4-21(5-2)25(23,24)17-10-8-16(9-11-17)19-18(22)14-20-12-6-7-15(3)13-20/h8-11,15H,4-7,12-14H2,1-3H3,(H,19,22)/t15-/m1/s1
InChIKeyYPNPIFBKTSXBFC-OAHLLOKOSA-N
MW367.52 g/mol
LogP2.39
Rot. Bonds7

About N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide

N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide (PubChem CID 2681860) has the molecular formula C18H29N3O3S and a molecular weight of 367.52 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
PubChem CID2681860
Molecular FormulaC18H29N3O3S
Molecular Weight367.52 g/mol
Exact Mass367.19
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](C)C2)cc1
InChIInChI=1S/C18H29N3O3S/c1-4-21(5-2)25(23,24)17-10-8-16(9-11-17)19-18(22)14-20-12-6-7-15(3)13-20/h8-11,15H,4-7,12-14H2,1-3H3,(H,19,22)/t15-/m1/s1
InChIKeyYPNPIFBKTSXBFC-OAHLLOKOSA-N
XLogP2.39
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.52
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide
CID 8901829
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 1152741
N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 1166743
N-(4-aminophenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 16779145
2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 11931064
N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 6914795
2-(3-methylpiperidin-1-yl)-N-pyridin-4-ylacetamide
CID 17066608
N-[4-(aminomethyl)phenyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 16779543
2-(3-methylpiperidin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 22197766
N-[3-(diethylsulfamoyl)phenyl]-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930625
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 7746228
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 109006520

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide (CID 2681860) is N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](C)C2)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide?
The InChIKey is YPNPIFBKTSXBFC-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H29N3O3S/c1-4-21(5-2)25(23,24)17-10-8-16(9-11-17)19-18(22)14-20-12-6-7-15(3)13-20/h8-11,15H,4-7,12-14H2,1-3H3,(H,19,22)/t15-/m1/s1.
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide?
N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide has a molecular weight of 367.52 g/mol, XLogP of 2.39, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide is sourced from PubChem (CID 2681860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).