N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide

C14H21NO4 — CID 65315716

IUPACN-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccccc1OCC(=O)NC(CO)CO
InChIInChI=1S/C14H21NO4/c1-10(2)12-5-3-4-6-13(12)19-9-14(18)15-11(7-16)8-17/h3-6,10-11,16-17H,7-9H2,1-2H3,(H,15,18)
InChIKeyQUPBXIKIKBNJOY-UHFFFAOYSA-N
MW267.32 g/mol
LogP0.66
Rot. Bonds7

About N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide

N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide (PubChem CID 65315716) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide
PubChem CID65315716
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC NameN-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccccc1OCC(=O)NC(CO)CO
InChIInChI=1S/C14H21NO4/c1-10(2)12-5-3-4-6-13(12)19-9-14(18)15-11(7-16)8-17/h3-6,10-11,16-17H,7-9H2,1-2H3,(H,15,18)
InChIKeyQUPBXIKIKBNJOY-UHFFFAOYSA-N
XLogP0.66
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-propan-2-yl-2-(2-propan-2-ylphenoxy)acetamide
CID 19168088
N-(4-hydroxy-3-methylsulfanylbutan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide
CID 103801148
1-N',5-N'-bis[2-(2-propan-2-ylphenoxy)acetyl]pentanedihydrazide
CID 3554714
N-[(1R)-1-(4-bromophenyl)ethyl]-2-(2-propan-2-ylphenoxy)acetamide
CID 8752279
2-(2-propan-2-ylphenoxy)-N-(1-thiophen-2-ylethyl)acetamide
CID 45154352
2-(2-propan-2-ylphenoxy)-N-[8-[[2-(2-propan-2-ylphenoxy)acetyl]amino]octyl]acetamide
CID 17233327
2-[2-[(1S)-1-hydroxyethyl]phenoxy]-N-propan-2-ylacetamide
CID 78931532
(3S)-3-(4-chlorophenyl)-3-[[2-(2-propan-2-ylphenoxy)acetyl]amino]propanoic acid
CID 7045006
N'-[2-(2-propan-2-ylphenoxy)acetyl]benzohydrazide
CID 922574
N-(6-hydroxyhexyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 103919361
N-[1-(4-methylphenyl)propyl]-2-(2-propan-2-ylphenoxy)acetamide
CID 17328368
N-(2-chloroprop-2-enyl)-2-(2-propan-2-ylphenoxy)acetamide
CID 113238561

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide (CID 65315716) is N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide is CC(C)c1ccccc1OCC(=O)NC(CO)CO.
What is the InChIKey of N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide?
The InChIKey is QUPBXIKIKBNJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-10(2)12-5-3-4-6-13(12)19-9-14(18)15-11(7-16)8-17/h3-6,10-11,16-17H,7-9H2,1-2H3,(H,15,18).
What are the key properties of N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide?
N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide has a molecular weight of 267.32 g/mol, XLogP of 0.66, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dihydroxypropan-2-yl)-2-(2-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 65315716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).