ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate

C14H21N3O6S — CID 7252300

IUPACethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate
SMILESCCOC(=O)NC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O
InChIInChI=1S/C14H21N3O6S/c1-4-17(5-2)24(21,22)11-7-8-13(19)16(9-11)10-12(18)15-14(20)23-6-3/h7-9H,4-6,10H2,1-3H3,(H,15,18,20)
InChIKeyIYCBZCICHMCPJO-UHFFFAOYSA-N
MW359.40 g/mol
LogP0.15
Rot. Bonds7

About ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate

ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate (PubChem CID 7252300) has the molecular formula C14H21N3O6S and a molecular weight of 359.40 g/mol. Its IUPAC name is ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate
PubChem CID7252300
Molecular FormulaC14H21N3O6S
Molecular Weight359.40 g/mol
Exact Mass359.12
IUPAC Nameethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate
SMILESCCOC(=O)NC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O
InChIInChI=1S/C14H21N3O6S/c1-4-17(5-2)24(21,22)11-7-8-13(19)16(9-11)10-12(18)15-14(20)23-6-3/h7-9H,4-6,10H2,1-3H3,(H,15,18,20)
InChIKeyIYCBZCICHMCPJO-UHFFFAOYSA-N
XLogP0.15
TPSA114.78 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate?
The IUPAC name of ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate (CID 7252300) is ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate.
What is the SMILES notation for ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate?
The canonical SMILES for ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate is CCOC(=O)NC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O.
What is the InChIKey of ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate?
The InChIKey is IYCBZCICHMCPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O6S/c1-4-17(5-2)24(21,22)11-7-8-13(19)16(9-11)10-12(18)15-14(20)23-6-3/h7-9H,4-6,10H2,1-3H3,(H,15,18,20).
What are the key properties of ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate?
ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate has a molecular weight of 359.40 g/mol, XLogP of 0.15, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetyl]carbamate is sourced from PubChem (CID 7252300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).