N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide

C18H29N3O3S — CID 119272853

IUPACN-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C2CCNCC2)c1
InChIInChI=1S/C18H29N3O3S/c1-5-21(6-2)25(23,24)16-11-13(3)14(4)17(12-16)20-18(22)15-7-9-19-10-8-15/h11-12,15,19H,5-10H2,1-4H3,(H,20,22)
InChIKeyYOFQHFQTLGDHLU-UHFFFAOYSA-N
MW367.52 g/mol
LogP2.27
Rot. Bonds6

About N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide

N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide (PubChem CID 119272853) has the molecular formula C18H29N3O3S and a molecular weight of 367.52 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide
PubChem CID119272853
Molecular FormulaC18H29N3O3S
Molecular Weight367.52 g/mol
Exact Mass367.19
IUPAC NameN-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C2CCNCC2)c1
InChIInChI=1S/C18H29N3O3S/c1-5-21(6-2)25(23,24)16-11-13(3)14(4)17(12-16)20-18(22)15-7-9-19-10-8-15/h11-12,15,19H,5-10H2,1-4H3,(H,20,22)
InChIKeyYOFQHFQTLGDHLU-UHFFFAOYSA-N
XLogP2.27
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.52
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]pyrrolidine-3-carboxamide
CID 119692557
3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119692536
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-1-methylsulfonylpiperidine-2-carboxamide
CID 43049414
2,2,2-trifluoroethyl 4-[[5-(diethylsulfamoyl)-2,3-dimethylphenyl]carbamoyl]piperidine-1-carboxylate
CID 24586987
N-(2-methyl-5-methylsulfonylphenyl)piperidine-4-carboxamide
CID 43703421
1-acetyl-N-[5-(diethylsulfamoyl)-2-methylphenyl]piperidine-4-carboxamide
CID 17447576
3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride
CID 119272848
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119683535
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 17446514
N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119261898
N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]cyclopropanecarboxamide
CID 26354488
N-[5-(diethylsulfamoyl)-2-piperidin-1-ylphenyl]cyclopropanecarboxamide
CID 7478657

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide (CID 119272853) is N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide is CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)C2CCNCC2)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide?
The InChIKey is YOFQHFQTLGDHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O3S/c1-5-21(6-2)25(23,24)16-11-13(3)14(4)17(12-16)20-18(22)15-7-9-19-10-8-15/h11-12,15,19H,5-10H2,1-4H3,(H,20,22).
What are the key properties of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide?
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide has a molecular weight of 367.52 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide is sourced from PubChem (CID 119272853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).