N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

C24H31N3O4S — CID 55593256

IUPACN-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)N(C2CC2)C2CCCc3ccccc32)c1
InChIInChI=1S/C24H31N3O4S/c1-3-26(4-2)32(30,31)20-14-15-23(28)25(16-20)17-24(29)27(19-12-13-19)22-11-7-9-18-8-5-6-10-21(18)22/h5-6,8,10,14-16,19,22H,3-4,7,9,11-13,17H2,1-2H3
InChIKeyQZWSBJIRZAGCRB-UHFFFAOYSA-N
MW457.60 g/mol
LogP2.95
Rot. Bonds8

About N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (PubChem CID 55593256) has the molecular formula C24H31N3O4S and a molecular weight of 457.60 g/mol. Its IUPAC name is N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
PubChem CID55593256
Molecular FormulaC24H31N3O4S
Molecular Weight457.60 g/mol
Exact Mass457.20
IUPAC NameN-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)N(C2CC2)C2CCCc3ccccc32)c1
InChIInChI=1S/C24H31N3O4S/c1-3-26(4-2)32(30,31)20-14-15-23(28)25(16-20)17-24(29)27(19-12-13-19)22-11-7-9-18-8-5-6-10-21(18)22/h5-6,8,10,14-16,19,22H,3-4,7,9,11-13,17H2,1-2H3
InChIKeyQZWSBJIRZAGCRB-UHFFFAOYSA-N
XLogP2.95
TPSA79.69 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.60
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The IUPAC name of N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide (CID 55593256) is N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The canonical SMILES for N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)N(C2CC2)C2CCCc3ccccc32)c1.
What is the InChIKey of N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
The InChIKey is QZWSBJIRZAGCRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O4S/c1-3-26(4-2)32(30,31)20-14-15-23(28)25(16-20)17-24(29)27(19-12-13-19)22-11-7-9-18-8-5-6-10-21(18)22/h5-6,8,10,14-16,19,22H,3-4,7,9,11-13,17H2,1-2H3.
What are the key properties of N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide?
N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide has a molecular weight of 457.60 g/mol, XLogP of 2.95, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide is sourced from PubChem (CID 55593256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).