N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide

C14H20N2O2 — CID 110459878

IUPACN-(5-acetamido-2-ethylphenyl)-2-methylpropanamide
SMILESCCc1ccc(NC(C)=O)cc1NC(=O)C(C)C
InChIInChI=1S/C14H20N2O2/c1-5-11-6-7-12(15-10(4)17)8-13(11)16-14(18)9(2)3/h6-9H,5H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyGKXHSMUYSMMKIC-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.80
Rot. Bonds4

About N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide

N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide (PubChem CID 110459878) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(5-acetamido-2-ethylphenyl)-2-methylpropanamide
PubChem CID110459878
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(5-acetamido-2-ethylphenyl)-2-methylpropanamide
SMILESCCc1ccc(NC(C)=O)cc1NC(=O)C(C)C
InChIInChI=1S/C14H20N2O2/c1-5-11-6-7-12(15-10(4)17)8-13(11)16-14(18)9(2)3/h6-9H,5H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyGKXHSMUYSMMKIC-UHFFFAOYSA-N
XLogP2.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(5-acetamido-2-ethylphenyl)-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-acetamido-2-ethylphenyl)-2-aminoacetamide
CID 39185204
N-[3-(2-acetamidoanilino)-4-ethylphenyl]acetamide
CID 163304121
N-(4-ethyl-3-sulfanylphenyl)acetamide
CID 130011196
N-(5-acetamido-2-ethylphenyl)-2,4-difluorobenzamide
CID 108797375
N-(5-acetamido-2-ethylphenyl)-2H-triazole-4-carboxamide
CID 110475529
N-[4-[(4-acetamidophenyl)methyl]phenyl]-2-methylpropanamide
CID 130256848
N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide
CID 62853430
(2S,3S)-N-(5-acetamido-2-methylphenyl)-2-amino-3-methylpentanamide
CID 61154615
N-(3-ethyl-4-propan-2-yloxyphenyl)acetamide
CID 66916731
N-(5-acetamido-2-methylphenyl)-2-chloropropanamide
CID 43696197
N-[3-hydroxy-4-(hydroxymethyl)phenyl]acetamide
CID 162349141
N-(2-ethyl-5-fluorophenyl)acetamide
CID 143900433

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide?
The IUPAC name of N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide (CID 110459878) is N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide?
The canonical SMILES for N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide is CCc1ccc(NC(C)=O)cc1NC(=O)C(C)C.
What is the InChIKey of N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide?
The InChIKey is GKXHSMUYSMMKIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-5-11-6-7-12(15-10(4)17)8-13(11)16-14(18)9(2)3/h6-9H,5H2,1-4H3,(H,15,17)(H,16,18).
What are the key properties of N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide?
N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide has a molecular weight of 248.33 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide is sourced from PubChem (CID 110459878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).