N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide

C20H24N2O3 — CID 112997501

IUPACN-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)CNC(=O)COc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-20(2,3)16-11-7-8-12-17(16)22-18(23)13-21-19(24)14-25-15-9-5-4-6-10-15/h4-12H,13-14H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyYVFALKQXMRYITL-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.12
Rot. Bonds6

About N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide

N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide (PubChem CID 112997501) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
PubChem CID112997501
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)CNC(=O)COc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-20(2,3)16-11-7-8-12-17(16)22-18(23)13-21-19(24)14-25-15-9-5-4-6-10-15/h4-12H,13-14H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyYVFALKQXMRYITL-UHFFFAOYSA-N
XLogP3.12
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 46665237
N-(5-tert-butyl-2-hydroxyphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 27673110
N-(2-tert-butylphenyl)-2-(4-chlorophenoxy)acetamide
CID 2632006
N-(2-tert-butylphenyl)-2-(4-fluorophenoxy)acetamide
CID 40597489
N-(2,5-dimethylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 9314105
N-(2-tert-butylphenyl)-2-(3-ethylphenoxy)acetamide
CID 7920123
ethyl N-[3-[2-(2-tert-butylanilino)-2-oxoethoxy]phenyl]carbamate
CID 29183042
N-[2-(2-tert-butylanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112997518
2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 1185791
N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 48735974
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-[(2-phenoxyacetyl)amino]acetamide
CID 32940179
N-[2-(2-tert-butylanilino)-2-oxoethyl]-3-methoxybenzamide
CID 112997486

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide?
The IUPAC name of N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide (CID 112997501) is N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide.
What is the SMILES notation for N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide?
The canonical SMILES for N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide is CC(C)(C)c1ccccc1NC(=O)CNC(=O)COc1ccccc1.
What is the InChIKey of N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide?
The InChIKey is YVFALKQXMRYITL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-20(2,3)16-11-7-8-12-17(16)22-18(23)13-21-19(24)14-25-15-9-5-4-6-10-15/h4-12H,13-14H2,1-3H3,(H,21,24)(H,22,23).
What are the key properties of N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide?
N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide has a molecular weight of 340.42 g/mol, XLogP of 3.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide is sourced from PubChem (CID 112997501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).