N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide

C14H21NO5 — CID 66170410

IUPACN-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide
SMILESCCOc1ccc(OCC(=O)NCC(C)(O)CO)cc1
InChIInChI=1S/C14H21NO5/c1-3-19-11-4-6-12(7-5-11)20-8-13(17)15-9-14(2,18)10-16/h4-7,16,18H,3,8-10H2,1-2H3,(H,15,17)
InChIKeyWGEAJNRWFBYQCP-UHFFFAOYSA-N
MW283.32 g/mol
LogP0.32
Rot. Bonds8

About N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide

N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide (PubChem CID 66170410) has the molecular formula C14H21NO5 and a molecular weight of 283.32 g/mol. Its IUPAC name is N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide
PubChem CID66170410
Molecular FormulaC14H21NO5
Molecular Weight283.32 g/mol
Exact Mass283.14
IUPAC NameN-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide
SMILESCCOc1ccc(OCC(=O)NCC(C)(O)CO)cc1
InChIInChI=1S/C14H21NO5/c1-3-19-11-4-6-12(7-5-11)20-8-13(17)15-9-14(2,18)10-16/h4-7,16,18H,3,8-10H2,1-2H3,(H,15,17)
InChIKeyWGEAJNRWFBYQCP-UHFFFAOYSA-N
XLogP0.32
TPSA88.02 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dihydroxy-2-methylpropyl)-2-phenoxyacetamide
CID 66169825
N-(2-cyclopropyl-2-hydroxypropyl)-2-(4-ethoxyphenoxy)acetamide
CID 90499308
N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenyl)sulfanylacetamide
CID 66170023
2-(4-ethoxyphenoxy)-N-[2-hydroxy-3-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 90498249
N-(2-hydroxy-2-methylbutyl)-2-phenoxyacetamide
CID 65114465
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(4-ethoxyphenoxy)acetamide
CID 134008150
2-(4-ethoxyphenoxy)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
CID 43390531
2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide
CID 65114746
3-[[2-(4-ethoxyphenoxy)acetyl]amino]-2-methyl-2-phenylpropanoic acid
CID 120700980
3-hydroxy-4-[[2-(4-methoxyphenoxy)acetyl]amino]-3-methylbutanoic acid
CID 66001139
3-hydroxy-3-methyl-4-[[2-(4-methylphenoxy)acetyl]amino]butanoic acid
CID 66003112
N-(2,3-dihydroxy-2-methylpropyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 66170658

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide?
The IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide (CID 66170410) is N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide.
What is the SMILES notation for N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide?
The canonical SMILES for N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide is CCOc1ccc(OCC(=O)NCC(C)(O)CO)cc1.
What is the InChIKey of N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide?
The InChIKey is WGEAJNRWFBYQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO5/c1-3-19-11-4-6-12(7-5-11)20-8-13(17)15-9-14(2,18)10-16/h4-7,16,18H,3,8-10H2,1-2H3,(H,15,17).
What are the key properties of N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide?
N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide has a molecular weight of 283.32 g/mol, XLogP of 0.32, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide is sourced from PubChem (CID 66170410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).