N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide

C16H17NO3 — CID 2308064

IUPACN,N-dimethyl-2-(4-phenoxyphenoxy)acetamide
SMILESCN(C)C(=O)COc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C16H17NO3/c1-17(2)16(18)12-19-13-8-10-15(11-9-13)20-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeyZGFGHHYESMWPQK-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.95
Rot. Bonds5

About N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide

N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide (PubChem CID 2308064) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-phenoxyphenoxy)acetamide
PubChem CID2308064
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN,N-dimethyl-2-(4-phenoxyphenoxy)acetamide
SMILESCN(C)C(=O)COc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C16H17NO3/c1-17(2)16(18)12-19-13-8-10-15(11-9-13)20-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeyZGFGHHYESMWPQK-UHFFFAOYSA-N
XLogP2.95
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide?
The IUPAC name of N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide (CID 2308064) is N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide?
The canonical SMILES for N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide is CN(C)C(=O)COc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide?
The InChIKey is ZGFGHHYESMWPQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-17(2)16(18)12-19-13-8-10-15(11-9-13)20-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide?
N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide has a molecular weight of 271.32 g/mol, XLogP of 2.95, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-phenoxyphenoxy)acetamide is sourced from PubChem (CID 2308064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).