N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide

C18H21NO2 — CID 40724453

IUPACN-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCCOc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO2/c1-14-3-7-16(8-4-14)13-18(20)19-11-12-21-17-9-5-15(2)6-10-17/h3-10H,11-13H2,1-2H3,(H,19,20)
InChIKeyWFFVXPAXMRRPGC-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.04
Rot. Bonds6

About N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide

N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide (PubChem CID 40724453) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide
PubChem CID40724453
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCCOc2ccc(C)cc2)cc1
InChIInChI=1S/C18H21NO2/c1-14-3-7-16(8-4-14)13-18(20)19-11-12-21-17-9-5-15(2)6-10-17/h3-10H,11-13H2,1-2H3,(H,19,20)
InChIKeyWFFVXPAXMRRPGC-UHFFFAOYSA-N
XLogP3.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-aminophenoxy)ethyl]-3-(4-methylphenyl)propanamide
CID 84816880
N-[2-(4-methylphenoxy)ethyl]pentanamide
CID 19174784
N-[2-(4-methylphenoxy)ethyl]-3-phenylpropanamide
CID 5227207
2-(4-phenylphenyl)-N-[2-(4-propylphenoxy)ethyl]acetamide
CID 100517253
5-bromo-N-[2-(4-methylphenoxy)ethyl]furan-2-carboxamide
CID 18113432
2-(4-bromophenyl)-N-[2-(3,4-dimethylphenoxy)ethyl]acetamide
CID 113101041
2,2-dimethyl-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]propanamide
CID 43021745
4-ethoxy-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]benzamide
CID 9366137
N-[2-(4-ethoxyphenoxy)ethyl]-2-(3-methylphenyl)acetamide
CID 30350207
3-(1,3-benzodioxol-5-yl)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 18121430
1-ethyl-3-[2-(4-methylphenoxy)ethyl]urea
CID 47103272
N-[2-[4-(2-oxopropyl)phenoxy]ethyl]acetamide
CID 70467709

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide (CID 40724453) is N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)NCCOc2ccc(C)cc2)cc1.
What is the InChIKey of N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide?
The InChIKey is WFFVXPAXMRRPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-14-3-7-16(8-4-14)13-18(20)19-11-12-21-17-9-5-15(2)6-10-17/h3-10H,11-13H2,1-2H3,(H,19,20).
What are the key properties of N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide?
N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide has a molecular weight of 283.37 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 40724453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).