2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide

C13H20N2O4S — CID 63859309

IUPAC2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide
SMILESCC(C)(CNC(=O)Cc1cccc(O)c1)NS(C)(=O)=O
InChIInChI=1S/C13H20N2O4S/c1-13(2,15-20(3,18)19)9-14-12(17)8-10-5-4-6-11(16)7-10/h4-7,15-16H,8-9H2,1-3H3,(H,14,17)
InChIKeyLXZSGBQFOUCTED-UHFFFAOYSA-N
MW300.38 g/mol
LogP0.38
Rot. Bonds6

About 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide

2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide (PubChem CID 63859309) has the molecular formula C13H20N2O4S and a molecular weight of 300.38 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide
PubChem CID63859309
Molecular FormulaC13H20N2O4S
Molecular Weight300.38 g/mol
Exact Mass300.11
IUPAC Name2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide
SMILESCC(C)(CNC(=O)Cc1cccc(O)c1)NS(C)(=O)=O
InChIInChI=1S/C13H20N2O4S/c1-13(2,15-20(3,18)19)9-14-12(17)8-10-5-4-6-11(16)7-10/h4-7,15-16H,8-9H2,1-3H3,(H,14,17)
InChIKeyLXZSGBQFOUCTED-UHFFFAOYSA-N
XLogP0.38
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dihydroxy-2-methylpropyl)-2-(3-hydroxyphenyl)acetamide
CID 66169594
2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 61399819
2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide
CID 103941340
N-tert-butyl-2-(3-hydroxyphenyl)acetamide
CID 61399885
2-[[[2-(3-hydroxyphenyl)acetyl]amino]methyl]-4,4-dimethylpentanoic acid
CID 107474342
N-(2-aminopropyl)-2-(3-hydroxyphenyl)acetamide
CID 63731250
2-(3-hydroxyphenyl)-N-[3-(methylamino)propyl]acetamide
CID 61399440
N-[2-(dimethylamino)-2-oxoethyl]-2-(3-hydroxyphenyl)acetamide
CID 61399713
(2R)-2-amino-N-[2-(methanesulfonamido)-2-methylpropyl]-3-phenylpropanamide
CID 63865578
2-amino-6-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide
CID 63863725
N-(2-cyanoethyl)-2-(3-hydroxyphenyl)acetamide
CID 62651288
2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]-5-methoxybenzamide
CID 63858949

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide?
The IUPAC name of 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide (CID 63859309) is 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide.
What is the SMILES notation for 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide?
The canonical SMILES for 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide is CC(C)(CNC(=O)Cc1cccc(O)c1)NS(C)(=O)=O.
What is the InChIKey of 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide?
The InChIKey is LXZSGBQFOUCTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4S/c1-13(2,15-20(3,18)19)9-14-12(17)8-10-5-4-6-11(16)7-10/h4-7,15-16H,8-9H2,1-3H3,(H,14,17).
What are the key properties of 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide?
2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide has a molecular weight of 300.38 g/mol, XLogP of 0.38, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide is sourced from PubChem (CID 63859309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).