N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide

C14H21NO2 — CID 113354468

IUPACN-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide
SMILESCC(C)(O)C(C)(C)NC(=O)Cc1ccccc1
InChIInChI=1S/C14H21NO2/c1-13(2,14(3,4)17)15-12(16)10-11-8-6-5-7-9-11/h5-9,17H,10H2,1-4H3,(H,15,16)
InChIKeyKYRUIOFRCHDATG-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.89
Rot. Bonds4

About N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide

N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide (PubChem CID 113354468) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide
PubChem CID113354468
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide
SMILESCC(C)(O)C(C)(C)NC(=O)Cc1ccccc1
InChIInChI=1S/C14H21NO2/c1-13(2,14(3,4)17)15-12(16)10-11-8-6-5-7-9-11/h5-9,17H,10H2,1-4H3,(H,15,16)
InChIKeyKYRUIOFRCHDATG-UHFFFAOYSA-N
XLogP1.89
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-naphthalen-1-ylacetamide
CID 103895382
N-(1-bromo-2-methylpropan-2-yl)-2-phenylacetamide
CID 114307896
2,3-dimethylbutane-2,3-diol;[(2-phenylacetyl)amino]methylboronic acid
CID 70153085
N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenylacetamide;hydrochloride
CID 119608428
N-(3-methylpent-1-yn-3-yl)-2-phenylacetamide
CID 3649343
2,2,3-trimethyl-3-[[2-(3-methylphenyl)acetyl]amino]butanoic acid
CID 65261339
3-ethoxy-2-methyl-3-oxo-2-[(2-phenylacetyl)amino]propanoic acid
CID 134098342
N-[1-cyano-1-(4-methylphenyl)ethyl]-2-phenylacetamide
CID 62707555
N-methyl-2,2-diphenyl-2-[(2-phenylacetyl)amino]acetamide
CID 10338453
N-[(2R)-3,3-dimethylbutan-2-yl]-2-phenylacetamide
CID 42561776
N-[2-(3-fluorophenyl)propan-2-yl]-2-phenylacetamide
CID 12790289
2-phenyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]acetamide
CID 110472120

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide?
The IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide (CID 113354468) is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide.
What is the SMILES notation for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide?
The canonical SMILES for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide is CC(C)(O)C(C)(C)NC(=O)Cc1ccccc1.
What is the InChIKey of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide?
The InChIKey is KYRUIOFRCHDATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-13(2,14(3,4)17)15-12(16)10-11-8-6-5-7-9-11/h5-9,17H,10H2,1-4H3,(H,15,16).
What are the key properties of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide?
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide has a molecular weight of 235.33 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-phenylacetamide is sourced from PubChem (CID 113354468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).