N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide

C15H21NO3 — CID 82156387

IUPACN-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide
SMILESCC(=O)c1ccc(OC(C)C)c(NC(=O)C(C)C)c1
InChIInChI=1S/C15H21NO3/c1-9(2)15(18)16-13-8-12(11(5)17)6-7-14(13)19-10(3)4/h6-10H,1-5H3,(H,16,18)
InChIKeyGTPMLPYVASXMNT-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.27
Rot. Bonds5

About N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide

N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide (PubChem CID 82156387) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide
PubChem CID82156387
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide
SMILESCC(=O)c1ccc(OC(C)C)c(NC(=O)C(C)C)c1
InChIInChI=1S/C15H21NO3/c1-9(2)15(18)16-13-8-12(11(5)17)6-7-14(13)19-10(3)4/h6-10H,1-5H3,(H,16,18)
InChIKeyGTPMLPYVASXMNT-UHFFFAOYSA-N
XLogP3.27
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-acetyl-2-propoxyphenyl)-2-methylpropanamide
CID 82156414
4-methoxy-3-(2-methylpropanoylamino)benzoic acid
CID 63742748
N-(3,4-dimethoxyphenyl)-4-methoxy-3-(2-methylpropanoylamino)benzamide
CID 118877995
1-(3-iodo-4-propan-2-yloxyphenyl)ethanone
CID 153246357
N-(5-benzoyl-2-methoxyphenyl)-2-methylpropanamide
CID 56687266
3-[[(2R)-2-(oxan-4-yl)propanoyl]amino]-4-propan-2-yloxybenzoic acid
CID 129469789
1-[4-propan-2-yloxy-3-(trifluoromethyl)phenyl]ethanone
CID 118619612
3-[4-(3-acetylphenoxy)butanoylamino]-4-propan-2-yloxybenzoic acid
CID 119196492
3-[2-(3-fluorophenyl)propanoylamino]-4-propan-2-yloxybenzoic acid
CID 119196657
N-(5-acetyl-2-propoxyphenyl)-2-ethylbutanamide
CID 82156416
3-[[2-(2,6-dimethylphenyl)acetyl]amino]-4-propan-2-yloxybenzoic acid
CID 120686173
3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide
CID 6459943

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide (CID 82156387) is N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide is CC(=O)c1ccc(OC(C)C)c(NC(=O)C(C)C)c1.
What is the InChIKey of N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide?
The InChIKey is GTPMLPYVASXMNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-9(2)15(18)16-13-8-12(11(5)17)6-7-14(13)19-10(3)4/h6-10H,1-5H3,(H,16,18).
What are the key properties of N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide?
N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide has a molecular weight of 263.34 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-2-propan-2-yloxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 82156387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).