N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide

C15H21NO3 — CID 115775825

IUPACN-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide
SMILESC=CCN(CCO)C(=O)C(C)Oc1ccc(C)cc1
InChIInChI=1S/C15H21NO3/c1-4-9-16(10-11-17)15(18)13(3)19-14-7-5-12(2)6-8-14/h4-8,13,17H,1,9-11H2,2-3H3
InChIKeyWQPRYUBCFCIOOK-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.77
Rot. Bonds7

About N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide

N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide (PubChem CID 115775825) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide
PubChem CID115775825
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide
SMILESC=CCN(CCO)C(=O)C(C)Oc1ccc(C)cc1
InChIInChI=1S/C15H21NO3/c1-4-9-16(10-11-17)15(18)13(3)19-14-7-5-12(2)6-8-14/h4-8,13,17H,1,9-11H2,2-3H3
InChIKeyWQPRYUBCFCIOOK-UHFFFAOYSA-N
XLogP1.77
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(4-fluorophenoxy)-N-(2-hydroxyethyl)-N-propylpropanamide
CID 60656705
(2S)-2-amino-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide
CID 104869516
N-cyclobutyl-N-(3-hydroxypropyl)-2-(4-methylphenoxy)propanamide
CID 102866166
2-(4-bromophenoxy)-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 103857325
N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-(3-methylphenoxy)propanamide
CID 115772456
(2S)-2-(3-methylphenoxy)-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-prop-2-enylpropanamide
CID 8894838
2-[4-(4-methylphenyl)phenoxy]propanoic acid
CID 16769111
N-(3-amino-3-oxopropyl)-N-benzyl-2-(4-methylphenoxy)propanamide
CID 43888170
N-(2-hydroxyethyl)-3,5-dimethyl-N-prop-2-enylbenzamide
CID 113340642
1-(2-hydroxyethyl)-3-[2-methyl-2-(4-methylphenyl)propyl]-1-prop-2-enylurea
CID 111424304
N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
CID 115771406
N-[(4-fluorophenyl)methyl]-N-methyl-2-(4-methylphenoxy)propanamide
CID 78770345

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide (CID 115775825) is N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide is C=CCN(CCO)C(=O)C(C)Oc1ccc(C)cc1.
What is the InChIKey of N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide?
The InChIKey is WQPRYUBCFCIOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-4-9-16(10-11-17)15(18)13(3)19-14-7-5-12(2)6-8-14/h4-8,13,17H,1,9-11H2,2-3H3.
What are the key properties of N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide?
N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide has a molecular weight of 263.34 g/mol, XLogP of 1.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(4-methylphenoxy)-N-prop-2-enylpropanamide is sourced from PubChem (CID 115775825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).