N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide

C12H17NO3 — CID 166611028

IUPACN-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Oc1ccc(O)cc1
InChIInChI=1S/C12H17NO3/c1-4-13(3)12(15)9(2)16-11-7-5-10(14)6-8-11/h5-9,14H,4H2,1-3H3
InChIKeyAYFQNVXCHDRBMG-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.64
Rot. Bonds4

About N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide

N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide (PubChem CID 166611028) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide.

Molecular Properties

Compound NameN-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide
PubChem CID166611028
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC NameN-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Oc1ccc(O)cc1
InChIInChI=1S/C12H17NO3/c1-4-13(3)12(15)9(2)16-11-7-5-10(14)6-8-11/h5-9,14H,4H2,1-3H3
InChIKeyAYFQNVXCHDRBMG-UHFFFAOYSA-N
XLogP1.64
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(4-hydroxyphenoxy)propanamide
CID 67641252
N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide
CID 43143630
N,N-dimethyl-2-(4-propanoylphenoxy)propanamide
CID 43085562
2-(4-tert-butylphenoxy)-N,N-diethylpropanamide
CID 19204171
2-[4-(1-hydroxypropyl)phenoxy]-N,N-dimethylpropanamide
CID 43504470
2-[4-[(1S)-1-aminoethyl]phenoxy]-N,N-diethylpropanamide
CID 63367483
2-(7-hydroxynaphthalen-2-yl)oxy-N,N-dimethylpropanamide
CID 43143635
N-(1-aminopropan-2-yl)-2-(4-methoxyphenoxy)-N-methylpropanamide
CID 119584481
2-[2-(4-cyanophenoxy)propanoyl-methylamino]acetic acid
CID 43092177
N-methyl-2-phenoxy-N-(2,2,2-trifluoroethyl)propanamide
CID 78864188
2-(4-cyanophenoxy)-N,N-diethylpropanamide
CID 43083146
2-oxoethyl 2-(4-hydroxyphenoxy)propanoate
CID 88738844

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide?
The IUPAC name of N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide (CID 166611028) is N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide.
What is the SMILES notation for N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide?
The canonical SMILES for N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide is CCN(C)C(=O)C(C)Oc1ccc(O)cc1.
What is the InChIKey of N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide?
The InChIKey is AYFQNVXCHDRBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-4-13(3)12(15)9(2)16-11-7-5-10(14)6-8-11/h5-9,14H,4H2,1-3H3.
What are the key properties of N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide?
N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide has a molecular weight of 223.27 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-hydroxyphenoxy)-N-methylpropanamide is sourced from PubChem (CID 166611028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).