2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide

C15H23NO4 — CID 63365164

IUPAC2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide
SMILESCC[C@H](O)c1ccccc1OC(C)C(=O)NCCOC
InChIInChI=1S/C15H23NO4/c1-4-13(17)12-7-5-6-8-14(12)20-11(2)15(18)16-9-10-19-3/h5-8,11,13,17H,4,9-10H2,1-3H3,(H,16,18)/t11?,13-/m0/s1
InChIKeyKVTYREVIVBXBOI-YUZLPWPTSA-N
MW281.35 g/mol
LogP1.66
Rot. Bonds8

About 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide

2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide (PubChem CID 63365164) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide
PubChem CID63365164
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC Name2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide
SMILESCC[C@H](O)c1ccccc1OC(C)C(=O)NCCOC
InChIInChI=1S/C15H23NO4/c1-4-13(17)12-7-5-6-8-14(12)20-11(2)15(18)16-9-10-19-3/h5-8,11,13,17H,4,9-10H2,1-3H3,(H,16,18)/t11?,13-/m0/s1
InChIKeyKVTYREVIVBXBOI-YUZLPWPTSA-N
XLogP1.66
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 ≤ 51.66
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

2-[2-(1-hydroxypropyl)phenoxy]-N-(3-methoxypropyl)propanamide
CID 43503502
2-(2-ethylphenoxy)-N-(2-methoxyethyl)propanamide
CID 53284936
N-cyclopropyl-2-[2-(1-hydroxypropyl)phenoxy]propanamide
CID 43503504
N-ethyl-2-[2-[(1R)-1-hydroxyethyl]phenoxy]propanamide
CID 55189875
N-cyclopentyl-2-[2-(1-hydroxypropyl)phenoxy]propanamide
CID 43503517
N-butyl-2-[2-[(1R)-1-hydroxyethyl]phenoxy]propanamide
CID 63364873
(2S)-N-(2-methoxyethyl)-2-phenoxypropanamide
CID 2162450
2-(2,3-dichlorophenoxy)-N-(2-methoxyethyl)propanamide
CID 46452752
2-(2-carbamothioylphenoxy)-N-(2-methoxyethyl)propanamide
CID 43116911
(2R)-N-ethyl-2-(2-propan-2-ylphenoxy)propanamide
CID 92685149
N,N-diethyl-2-[2-[(1S)-1-hydroxypropyl]phenoxy]propanamide
CID 78930736
2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]-N-(2-methoxyethyl)propanamide
CID 78946946

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide (CID 63365164) is 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide is CC[C@H](O)c1ccccc1OC(C)C(=O)NCCOC.
What is the InChIKey of 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide?
The InChIKey is KVTYREVIVBXBOI-YUZLPWPTSA-N. The full InChI is InChI=1S/C15H23NO4/c1-4-13(17)12-7-5-6-8-14(12)20-11(2)15(18)16-9-10-19-3/h5-8,11,13,17H,4,9-10H2,1-3H3,(H,16,18)/t11?,13-/m0/s1.
What are the key properties of 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide?
2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide has a molecular weight of 281.35 g/mol, XLogP of 1.66, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1S)-1-hydroxypropyl]phenoxy]-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 63365164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).