2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide

C18H19N3O4S — CID 5097519

IUPAC2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide
SMILESCC(C)N(CC(=O)Nc1ccon1)S(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C18H19N3O4S/c1-13(2)21(12-18(22)19-17-10-11-25-20-17)26(23,24)16-9-5-7-14-6-3-4-8-15(14)16/h3-11,13H,12H2,1-2H3,(H,19,20,22)
InChIKeyYARVMCYQVOUTET-UHFFFAOYSA-N
MW373.43 g/mol
LogP2.87
Rot. Bonds6

About 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide

2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide (PubChem CID 5097519) has the molecular formula C18H19N3O4S and a molecular weight of 373.43 g/mol. Its IUPAC name is 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide
PubChem CID5097519
Molecular FormulaC18H19N3O4S
Molecular Weight373.43 g/mol
Exact Mass373.11
IUPAC Name2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide
SMILESCC(C)N(CC(=O)Nc1ccon1)S(=O)(=O)c1cccc2ccccc12
InChIInChI=1S/C18H19N3O4S/c1-13(2)21(12-18(22)19-17-10-11-25-20-17)26(23,24)16-9-5-7-14-6-3-4-8-15(14)16/h3-11,13H,12H2,1-2H3,(H,19,20,22)
InChIKeyYARVMCYQVOUTET-UHFFFAOYSA-N
XLogP2.87
TPSA92.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.43
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-acetamidophenyl)sulfonyl-propan-2-ylamino]-N-(1,2-oxazol-3-yl)acetamide
CID 5071176
2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]acetamide
CID 115684041
2-[3-methylbutyl(naphthalen-1-ylcarbamoyl)amino]-N-(1,2-oxazol-3-yl)acetamide
CID 42769320
2-[hexyl(naphthalen-1-ylsulfonyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 42769352
N-[3-tert-butyl-1-(2,3-dimethylphenyl)pyrazol-5-yl]-2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]acetamide
CID 4036059
2-[3-methylbutyl(methylsulfonyl)amino]-N-(1,2-oxazol-3-yl)acetamide
CID 42771763
N-(2-bromoethyl)-N-propan-2-ylnaphthalene-1-sulfonamide
CID 114795644
2-[naphthalen-2-ylsulfonyl(pentyl)amino]-N-(1,2-oxazol-3-yl)acetamide
CID 42769416
N-butan-2-yl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide
CID 5085996
N-ethyl-2,2-dimethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]propanamide
CID 814450
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propan-2-ylcyclopropanecarboxamide
CID 813725
N-methyl-N-propan-2-ylnaphthalene-1-sulfonamide
CID 21131549

Frequently Asked Questions

What is the IUPAC name of 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide (CID 5097519) is 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide is CC(C)N(CC(=O)Nc1ccon1)S(=O)(=O)c1cccc2ccccc12.
What is the InChIKey of 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide?
The InChIKey is YARVMCYQVOUTET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4S/c1-13(2)21(12-18(22)19-17-10-11-25-20-17)26(23,24)16-9-5-7-14-6-3-4-8-15(14)16/h3-11,13H,12H2,1-2H3,(H,19,20,22).
What are the key properties of 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide?
2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide has a molecular weight of 373.43 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[naphthalen-1-ylsulfonyl(propan-2-yl)amino]-N-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 5097519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).