N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide

C14H21NO4 — CID 61269414

IUPACN,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide
SMILESCCN(CC)C(=O)COc1cc(OC)ccc1CO
InChIInChI=1S/C14H21NO4/c1-4-15(5-2)14(17)10-19-13-8-12(18-3)7-6-11(13)9-16/h6-8,16H,4-5,9-10H2,1-3H3
InChIKeyQPAVTCRRAFYNJW-UHFFFAOYSA-N
MW267.32 g/mol
LogP1.43
Rot. Bonds7

About N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide

N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide (PubChem CID 61269414) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide
PubChem CID61269414
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC NameN,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide
SMILESCCN(CC)C(=O)COc1cc(OC)ccc1CO
InChIInChI=1S/C14H21NO4/c1-4-15(5-2)14(17)10-19-13-8-12(18-3)7-6-11(13)9-16/h6-8,16H,4-5,9-10H2,1-3H3
InChIKeyQPAVTCRRAFYNJW-UHFFFAOYSA-N
XLogP1.43
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-ethoxy-4-methoxyphenyl)methanol
CID 61267380
2-(2,4-dimethoxyphenyl)-N,N-diethylacetamide
CID 60651948
3-[2-(hydroxymethyl)-5-methoxyphenoxy]-N,N-dimethylpropanamide
CID 61269047
2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-ethyl-N-methylacetamide
CID 61268758
N,N-diethyl-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 112787506
[2-(2,2-difluoroethoxy)-4-methoxyphenyl]methanol
CID 61269046
N-ethyl-2-[5-methoxy-2-[(propan-2-ylamino)methyl]phenoxy]-N-methylacetamide
CID 61267271
(2-docosoxy-4-methoxyphenyl)methanol
CID 53257210
2-(2-chloro-4-methoxyphenyl)-N,N-diethylacetamide
CID 110769985
ethyl 2-[2-(aminomethyl)-5-methoxyphenoxy]acetate
CID 61267782
2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-cyclopropyl-N-ethylacetamide
CID 61488645
N,N-diethyl-2-(2-methoxy-4-methylphenoxy)acetamide
CID 60626763

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide?
The IUPAC name of N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide (CID 61269414) is N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide.
What is the SMILES notation for N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide?
The canonical SMILES for N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide is CCN(CC)C(=O)COc1cc(OC)ccc1CO.
What is the InChIKey of N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide?
The InChIKey is QPAVTCRRAFYNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-4-15(5-2)14(17)10-19-13-8-12(18-3)7-6-11(13)9-16/h6-8,16H,4-5,9-10H2,1-3H3.
What are the key properties of N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide?
N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide has a molecular weight of 267.32 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-(hydroxymethyl)-5-methoxyphenoxy]acetamide is sourced from PubChem (CID 61269414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).