N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide

C20H25NO2 — CID 42902003

IUPACN-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide
SMILESCC(C)Cc1ccc(C(C)NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C20H25NO2/c1-15(2)13-17-9-11-18(12-10-17)16(3)21-20(22)14-23-19-7-5-4-6-8-19/h4-12,15-16H,13-14H2,1-3H3,(H,21,22)
InChIKeyWNAPOEICKCZABP-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.14
Rot. Bonds7

About N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide

N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide (PubChem CID 42902003) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide
PubChem CID42902003
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC NameN-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide
SMILESCC(C)Cc1ccc(C(C)NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C20H25NO2/c1-15(2)13-17-9-11-18(12-10-17)16(3)21-20(22)14-23-19-7-5-4-6-8-19/h4-12,15-16H,13-14H2,1-3H3,(H,21,22)
InChIKeyWNAPOEICKCZABP-UHFFFAOYSA-N
XLogP4.14
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-ethylphenyl)ethyl]-2-phenoxyacetamide
CID 17326821
2-(2-hydroxyphenoxy)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 78771813
N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(4-propanoylphenoxy)acetamide
CID 7788220
2-(2-methoxyphenoxy)-N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 2608512
2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide
CID 86249193
N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide
CID 7936643
2-methoxy-3-[4-[2-oxo-2-(1-phenylethylamino)ethoxy]phenyl]propanoic acid
CID 23132719
2-[2-[[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethoxy]benzamide
CID 7283926
N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide
CID 7899710
2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 836085
2-ethoxy-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 60636134
2-(4-bromophenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 879347

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide?
The IUPAC name of N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide (CID 42902003) is N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide?
The canonical SMILES for N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide is CC(C)Cc1ccc(C(C)NC(=O)COc2ccccc2)cc1.
What is the InChIKey of N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide?
The InChIKey is WNAPOEICKCZABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-15(2)13-17-9-11-18(12-10-17)16(3)21-20(22)14-23-19-7-5-4-6-8-19/h4-12,15-16H,13-14H2,1-3H3,(H,21,22).
What are the key properties of N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide?
N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide has a molecular weight of 311.43 g/mol, XLogP of 4.14, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide is sourced from PubChem (CID 42902003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).