[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate

C15H21NO4 — CID 71901844

IUPAC[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
SMILESCCC(C)(C)NC(=O)COC(=O)Cc1ccc(O)cc1
InChIInChI=1S/C15H21NO4/c1-4-15(2,3)16-13(18)10-20-14(19)9-11-5-7-12(17)8-6-11/h5-8,17H,4,9-10H2,1-3H3,(H,16,18)
InChIKeyGHLHKKUUJGSNFH-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.78
Rot. Bonds6

About [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate

[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate (PubChem CID 71901844) has the molecular formula C15H21NO4 and a molecular weight of 279.34 g/mol. Its IUPAC name is [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate.

Molecular Properties

Compound Name[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
PubChem CID71901844
Molecular FormulaC15H21NO4
Molecular Weight279.34 g/mol
Exact Mass279.15
IUPAC Name[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
SMILESCCC(C)(C)NC(=O)COC(=O)Cc1ccc(O)cc1
InChIInChI=1S/C15H21NO4/c1-4-15(2,3)16-13(18)10-20-14(19)9-11-5-7-12(17)8-6-11/h5-8,17H,4,9-10H2,1-3H3,(H,16,18)
InChIKeyGHLHKKUUJGSNFH-UHFFFAOYSA-N
XLogP1.78
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate with MolForge

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Related Compounds

[2-(2-methylbutan-2-ylamino)-2-oxoethyl] (Z)-2-cyano-3-(4-hydroxyphenyl)prop-2-enoate
CID 75534365
[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-[(4-tert-butylbenzoyl)amino]acetate
CID 9492401
(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
CID 141285444
[2-(tert-butylamino)-2-oxoethyl] 2-(3,4-dimethylphenyl)acetate
CID 2540902
[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 3-(3-aminophenyl)propanoate
CID 80695577
[2-(3-acetamidoanilino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8671933
[[4,6-bis[[2-(4-hydroxyphenyl)acetyl]oxymethylamino]-1,3,5-triazin-2-yl]amino]methyl 2-(4-hydroxyphenyl)acetate
CID 122595443
[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8672077
[2-(3,4-diethoxyanilino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8672049
2-(4-hydroxyphenyl)sulfanyl-N-(2-methylbutan-2-yl)acetamide
CID 47298335
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8672080
[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 8581903

Frequently Asked Questions

What is the IUPAC name of [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
The IUPAC name of [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate (CID 71901844) is [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate.
What is the SMILES notation for [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
The canonical SMILES for [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate is CCC(C)(C)NC(=O)COC(=O)Cc1ccc(O)cc1.
What is the InChIKey of [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
The InChIKey is GHLHKKUUJGSNFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO4/c1-4-15(2,3)16-13(18)10-20-14(19)9-11-5-7-12(17)8-6-11/h5-8,17H,4,9-10H2,1-3H3,(H,16,18).
What are the key properties of [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate has a molecular weight of 279.34 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate is sourced from PubChem (CID 71901844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).