2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide

C15H23NO — CID 99626723

IUPAC2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
SMILESCCc1ccc(CC(=O)N[C@H](C)C(C)C)cc1
InChIInChI=1S/C15H23NO/c1-5-13-6-8-14(9-7-13)10-15(17)16-12(4)11(2)3/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)/t12-/m1/s1
InChIKeyMIKKHDCQFYAYDQ-GFCCVEGCSA-N
MW233.35 g/mol
LogP2.95
Rot. Bonds5

About 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide

2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide (PubChem CID 99626723) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
PubChem CID99626723
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
SMILESCCc1ccc(CC(=O)N[C@H](C)C(C)C)cc1
InChIInChI=1S/C15H23NO/c1-5-13-6-8-14(9-7-13)10-15(17)16-12(4)11(2)3/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)/t12-/m1/s1
InChIKeyMIKKHDCQFYAYDQ-GFCCVEGCSA-N
XLogP2.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 94124569
4-(4-ethylphenyl)-N-(3-methylbutan-2-yl)-4-oxobutanamide
CID 78780258
N-[1-(4-ethylphenyl)ethyl]-2-phenylacetamide
CID 2854113
2-(4-ethylphenyl)-N-methylacetamide
CID 56921087
2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 93236026
(2S)-2-[[2-(4-ethylphenyl)acetyl]amino]hexanoic acid
CID 120615590
1-(4-ethylphenyl)-3,4-dimethylpentan-2-one
CID 114963410
2-(4-aminophenyl)-N-(3-methylpentan-2-yl)acetamide
CID 54950191
2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 62328197
2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 60688155
2-(3-aminophenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 94459377
2-(4-ethylphenyl)-N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]acetamide
CID 100589508

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide?
The IUPAC name of 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide (CID 99626723) is 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide.
What is the SMILES notation for 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide?
The canonical SMILES for 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide is CCc1ccc(CC(=O)N[C@H](C)C(C)C)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide?
The InChIKey is MIKKHDCQFYAYDQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H23NO/c1-5-13-6-8-14(9-7-13)10-15(17)16-12(4)11(2)3/h6-9,11-12H,5,10H2,1-4H3,(H,16,17)/t12-/m1/s1.
What are the key properties of 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide?
2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide has a molecular weight of 233.35 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide is sourced from PubChem (CID 99626723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).