2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide

C18H29N3O4S — CID 7768213

IUPAC2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)N[C@H]2CCCC[C@@H]2C)c1
InChIInChI=1S/C18H29N3O4S/c1-4-21(5-2)26(24,25)15-10-11-18(23)20(12-15)13-17(22)19-16-9-7-6-8-14(16)3/h10-12,14,16H,4-9,13H2,1-3H3,(H,19,22)/t14-,16-/m0/s1
InChIKeyCJNNCQCKTMDSFJ-HOCLYGCPSA-N
MW383.51 g/mol
LogP1.57
Rot. Bonds7

About 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide (PubChem CID 7768213) has the molecular formula C18H29N3O4S and a molecular weight of 383.51 g/mol. Its IUPAC name is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide.

Molecular Properties

Compound Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
PubChem CID7768213
Molecular FormulaC18H29N3O4S
Molecular Weight383.51 g/mol
Exact Mass383.19
IUPAC Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)N[C@H]2CCCC[C@@H]2C)c1
InChIInChI=1S/C18H29N3O4S/c1-4-21(5-2)26(24,25)15-10-11-18(23)20(12-15)13-17(22)19-16-9-7-6-8-14(16)3/h10-12,14,16H,4-9,13H2,1-3H3,(H,19,22)/t14-,16-/m0/s1
InChIKeyCJNNCQCKTMDSFJ-HOCLYGCPSA-N
XLogP1.57
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.51
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide?
The IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide (CID 7768213) is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide.
What is the SMILES notation for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide?
The canonical SMILES for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide is CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)N[C@H]2CCCC[C@@H]2C)c1.
What is the InChIKey of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide?
The InChIKey is CJNNCQCKTMDSFJ-HOCLYGCPSA-N. The full InChI is InChI=1S/C18H29N3O4S/c1-4-21(5-2)26(24,25)15-10-11-18(23)20(12-15)13-17(22)19-16-9-7-6-8-14(16)3/h10-12,14,16H,4-9,13H2,1-3H3,(H,19,22)/t14-,16-/m0/s1.
What are the key properties of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide?
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide has a molecular weight of 383.51 g/mol, XLogP of 1.57, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide is sourced from PubChem (CID 7768213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).