2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide

C16H26N2O5S — CID 59267898

IUPAC2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide
SMILESCC(C)(CO)c1cc(NC(=O)C(C)(C)S(=O)(=O)C2CCCC2)no1
InChIInChI=1S/C16H26N2O5S/c1-15(2,10-19)12-9-13(18-23-12)17-14(20)16(3,4)24(21,22)11-7-5-6-8-11/h9,11,19H,5-8,10H2,1-4H3,(H,17,18,20)
InChIKeyJKLGMYWBUIKAJQ-UHFFFAOYSA-N
MW358.46 g/mol
LogP2.02
Rot. Bonds6

About 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide

2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide (PubChem CID 59267898) has the molecular formula C16H26N2O5S and a molecular weight of 358.46 g/mol. Its IUPAC name is 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide.

Molecular Properties

Compound Name2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide
PubChem CID59267898
Molecular FormulaC16H26N2O5S
Molecular Weight358.46 g/mol
Exact Mass358.16
IUPAC Name2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide
SMILESCC(C)(CO)c1cc(NC(=O)C(C)(C)S(=O)(=O)C2CCCC2)no1
InChIInChI=1S/C16H26N2O5S/c1-15(2,10-19)12-9-13(18-23-12)17-14(20)16(3,4)24(21,22)11-7-5-6-8-11/h9,11,19H,5-8,10H2,1-4H3,(H,17,18,20)
InChIKeyJKLGMYWBUIKAJQ-UHFFFAOYSA-N
XLogP2.02
TPSA109.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-cyclopentylsulfonyl-N-[5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide
CID 56603435
N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-[methylidene-(oxan-4-yl)-oxo-λ6-sulfanyl]prop-2-enamide
CID 89078444
2-(cyclopropylmethylsulfonyl)-N-[5-(1-methoxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide
CID 59267923
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-methyl-2-(2-methylpropylsulfonyl)propanamide
CID 25004378
1-(5-tert-butyl-1,2-oxazol-3-yl)-3-(2-cyclopropyl-1-hydroxypropan-2-yl)urea
CID 111976377
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-methyl-2-[methylsulfonyl(pyrrolidin-3-yl)methyl]sulfonylpropanamide
CID 87267505
N,2-dimethyl-3-[5-[[2-methyl-2-(oxan-4-ylsulfonyl)propanoyl]amino]-1,2-oxazol-3-yl]propanamide
CID 67309679
methyl 2-methyl-2-[5-[[2-methyl-2-(oxan-4-ylsulfonyl)propanoyl]amino]-1,2-oxazol-3-yl]propanoate
CID 56603323
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(3,4-dichlorophenyl)sulfonyl-2-methylpropanamide
CID 59662620
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(2,5-dimethylthiophen-3-yl)sulfonyl-2-methylpropanamide
CID 58198607
N-[3-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-5-yl]-2-methyl-2-(oxan-4-ylmethylsulfonyl)propanamide
CID 45256132
2-methyl-N-[3-[2-methyl-3-(oxan-2-yloxy)butan-2-yl]-1,2-oxazol-5-yl]-2-(oxan-4-ylsulfonyl)propanamide
CID 59253279

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide?
The IUPAC name of 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide (CID 59267898) is 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide.
What is the SMILES notation for 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide?
The canonical SMILES for 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide is CC(C)(CO)c1cc(NC(=O)C(C)(C)S(=O)(=O)C2CCCC2)no1.
What is the InChIKey of 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide?
The InChIKey is JKLGMYWBUIKAJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O5S/c1-15(2,10-19)12-9-13(18-23-12)17-14(20)16(3,4)24(21,22)11-7-5-6-8-11/h9,11,19H,5-8,10H2,1-4H3,(H,17,18,20).
What are the key properties of 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide?
2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide has a molecular weight of 358.46 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentylsulfonyl-N-[5-(1-hydroxy-2-methylpropan-2-yl)-1,2-oxazol-3-yl]-2-methylpropanamide is sourced from PubChem (CID 59267898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).