N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide

C19H23NO2 — CID 8923326

IUPACN-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide
SMILESCC(C)[C@H](C)NC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C19H23NO2/c1-14(2)15(3)20-19(21)13-22-18-12-8-7-11-17(18)16-9-5-4-6-10-16/h4-12,14-15H,13H2,1-3H3,(H,20,21)/t15-/m0/s1
InChIKeyFJLMFQXXRQIQGH-HNNXBMFYSA-N
MW297.40 g/mol
LogP3.89
Rot. Bonds6

About N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide

N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide (PubChem CID 8923326) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide
PubChem CID8923326
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide
SMILESCC(C)[C@H](C)NC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C19H23NO2/c1-14(2)15(3)20-19(21)13-22-18-12-8-7-11-17(18)16-9-5-4-6-10-16/h4-12,14-15H,13H2,1-3H3,(H,20,21)/t15-/m0/s1
InChIKeyFJLMFQXXRQIQGH-HNNXBMFYSA-N
XLogP3.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-3-methyl-2-[[2-(2-phenylphenoxy)acetyl]amino]butanoic acid
CID 9157386
N-(1-methoxypropan-2-yl)-2-(2-phenylphenoxy)acetamide
CID 18166557
2-[2-(hydroxymethyl)phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 60773074
N-[(2S)-3-methylbutan-2-yl]-2-(2-methylphenoxy)acetamide
CID 94223613
3-methyl-N'-[2-(2-phenylphenoxy)acetyl]butanehydrazide
CID 9470420
2-(2-iodophenoxy)-N-(3-methylbutan-2-yl)acetamide
CID 43075465
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(2-phenylphenoxy)acetamide
CID 7948811
N-(3-methylbutan-2-yl)-2-(2-propoxyphenoxy)acetamide
CID 78767914
N'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584
N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide
CID 7936643
2-(2-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 5089372
2-[2-[1-(methylamino)ethyl]phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 61489481

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide?
The IUPAC name of N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide (CID 8923326) is N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide.
What is the SMILES notation for N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide?
The canonical SMILES for N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide is CC(C)[C@H](C)NC(=O)COc1ccccc1-c1ccccc1.
What is the InChIKey of N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide?
The InChIKey is FJLMFQXXRQIQGH-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-14(2)15(3)20-19(21)13-22-18-12-8-7-11-17(18)16-9-5-4-6-10-16/h4-12,14-15H,13H2,1-3H3,(H,20,21)/t15-/m0/s1.
What are the key properties of N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide?
N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide has a molecular weight of 297.40 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide is sourced from PubChem (CID 8923326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).