2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide

C15H23NO4 — CID 115495985

IUPAC2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)Oc1ccc(CC(C)O)cc1
InChIInChI=1S/C15H23NO4/c1-11(17)10-13-4-6-14(7-5-13)20-12(2)15(18)16-8-9-19-3/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyDFGMZFHJYBHBIV-UHFFFAOYSA-N
MW281.35 g/mol
LogP1.14
Rot. Bonds8

About 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide

2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide (PubChem CID 115495985) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide
PubChem CID115495985
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC Name2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)Oc1ccc(CC(C)O)cc1
InChIInChI=1S/C15H23NO4/c1-11(17)10-13-4-6-14(7-5-13)20-12(2)15(18)16-8-9-19-3/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18)
InChIKeyDFGMZFHJYBHBIV-UHFFFAOYSA-N
XLogP1.14
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.35
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide
CID 115495782
2-[4-(2-amino-2-sulfanylideneethyl)phenoxy]-N-(2-methoxyethyl)propanamide
CID 43116983
2-[4-(2-hydroxypropyl)phenoxy]-N-pentylpropanamide
CID 115495866
(2S)-N-(2-methoxyethyl)-2-phenoxypropanamide
CID 2162450
2-[4-(2-hydroxypropyl)phenoxy]-N-prop-2-ynylpropanamide
CID 115495948
2-[4-(2-aminopropyl)phenoxy]-N-(3-methoxypropyl)propanamide
CID 60906628
2-(4-carbamothioylphenoxy)-N-(2-methoxyethyl)propanamide
CID 43116881
2-[4-(2-hydroxypropyl)phenoxy]-N-pentan-3-ylpropanamide
CID 115495748
(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
CID 8949228
N-cyclopentyl-2-[4-(2-hydroxypropyl)phenoxy]propanamide
CID 115495986
2-(4-chlorophenoxy)-N-[2-[[2-(4-chlorophenyl)acetyl]amino]ethyl]propanamide
CID 108572718
2-(4-bromophenoxy)-N-(3-methoxypropyl)propanamide
CID 43083158

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide (CID 115495985) is 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide is COCCNC(=O)C(C)Oc1ccc(CC(C)O)cc1.
What is the InChIKey of 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide?
The InChIKey is DFGMZFHJYBHBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4/c1-11(17)10-13-4-6-14(7-5-13)20-12(2)15(18)16-8-9-19-3/h4-7,11-12,17H,8-10H2,1-3H3,(H,16,18).
What are the key properties of 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide?
2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide has a molecular weight of 281.35 g/mol, XLogP of 1.14, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 115495985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).