2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide

C16H24N2O3 — CID 103946030

IUPAC2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
SMILESCCC(C)(CCO)NC(=O)Cc1ccc(NC(C)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-4-16(3,9-10-19)18-15(21)11-13-5-7-14(8-6-13)17-12(2)20/h5-8,19H,4,9-11H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyMWCMAMUIFWSJKO-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.85
Rot. Bonds7

About 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide

2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide (PubChem CID 103946030) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
PubChem CID103946030
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
SMILESCCC(C)(CCO)NC(=O)Cc1ccc(NC(C)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-4-16(3,9-10-19)18-15(21)11-13-5-7-14(8-6-13)17-12(2)20/h5-8,19H,4,9-11H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyMWCMAMUIFWSJKO-UHFFFAOYSA-N
XLogP1.85
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-acetamidophenyl)-N-(4-hydroxy-2-methylbutan-2-yl)acetamide
CID 115869949
N-[4-[[(1-hydroxy-3-methylpentan-3-yl)amino]methyl]phenyl]acetamide
CID 103768915
2-(4-acetamidophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
CID 43393261
2-(4-acetamidophenyl)-N-(5-hydroxy-2,2-dimethylpentyl)acetamide
CID 75441471
N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
CID 114152459
N-(1-chloro-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
CID 114153136
N-(1-bromo-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
CID 114153294
N-[4-[[(4-hydroxy-2,2-dimethylbutyl)amino]methyl]phenyl]acetamide
CID 103707998
N-(1-amino-3-methylpentan-3-yl)-2-(4-fluorophenyl)acetamide
CID 114152519
N-(1-hydroxy-3-methylpentan-3-yl)propanamide
CID 103946136
2-(4-acetamidophenyl)-N-(2-hydroxyethyl)acetamide
CID 11287807
2-[4-(3-methylpentan-3-ylcarbamoylamino)phenyl]acetic acid
CID 106330639

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
The IUPAC name of 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide (CID 103946030) is 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide.
What is the SMILES notation for 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
The canonical SMILES for 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide is CCC(C)(CCO)NC(=O)Cc1ccc(NC(C)=O)cc1.
What is the InChIKey of 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
The InChIKey is MWCMAMUIFWSJKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-4-16(3,9-10-19)18-15(21)11-13-5-7-14(8-6-13)17-12(2)20/h5-8,19H,4,9-11H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.85, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenyl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide is sourced from PubChem (CID 103946030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).