2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide

C14H19NO4 — CID 43267929

IUPAC2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)Oc1ccc(OC)cc1CO
InChIInChI=1S/C14H19NO4/c1-4-7-15-14(17)10(2)19-13-6-5-12(18-3)8-11(13)9-16/h4-6,8,10,16H,1,7,9H2,2-3H3,(H,15,17)
InChIKeyRURJHCMJCBFFOB-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.26
Rot. Bonds7

About 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide

2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide (PubChem CID 43267929) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide
PubChem CID43267929
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)Oc1ccc(OC)cc1CO
InChIInChI=1S/C14H19NO4/c1-4-7-15-14(17)10(2)19-13-6-5-12(18-3)8-11(13)9-16/h4-6,8,10,16H,1,7,9H2,2-3H3,(H,15,17)
InChIKeyRURJHCMJCBFFOB-UHFFFAOYSA-N
XLogP1.26
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-(2-methylpropyl)propanamide
CID 43267928
2-[2-(2-aminoethyl)-5-methoxyphenoxy]-N-prop-2-enylpropanamide
CID 61267293
2-[4-chloro-2-(hydroxymethyl)-6-methoxyphenoxy]-N-prop-2-enylpropanamide
CID 104666115
2-[2-(hydroxymethyl)-5-methoxyphenoxy]-N-propan-2-ylpropanamide
CID 61267389
N-ethyl-2-[4-methoxy-2-(methylaminomethyl)phenoxy]propanamide
CID 43276266
2-[2-(hydroxymethyl)-5-methoxyphenoxy]-N-(3-methylbutyl)propanamide
CID 61267766
2-[4-chloro-2-(methylaminomethyl)phenoxy]-N-prop-2-enylpropanamide
CID 60881074
2-[2-(hydroxymethyl)-5-methoxyphenoxy]-N-pentylpropanamide
CID 61267387
2-naphthalen-2-yloxy-N-prop-2-enylpropanamide
CID 12873693
2-(2-hydroxyphenoxy)-N-prop-2-enylpropanamide
CID 43143434
2-(4-iodophenoxy)-N-prop-2-enylpropanamide
CID 60675232
2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]-N-prop-2-enylpropanamide
CID 79794355

Frequently Asked Questions

What is the IUPAC name of 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide?
The IUPAC name of 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide (CID 43267929) is 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide.
What is the SMILES notation for 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide?
The canonical SMILES for 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide is C=CCNC(=O)C(C)Oc1ccc(OC)cc1CO.
What is the InChIKey of 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide?
The InChIKey is RURJHCMJCBFFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-4-7-15-14(17)10(2)19-13-6-5-12(18-3)8-11(13)9-16/h4-6,8,10,16H,1,7,9H2,2-3H3,(H,15,17).
What are the key properties of 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide?
2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide has a molecular weight of 265.31 g/mol, XLogP of 1.26, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(hydroxymethyl)-4-methoxyphenoxy]-N-prop-2-enylpropanamide is sourced from PubChem (CID 43267929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).