2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone

C15H21NO4 — CID 78930986

IUPAC2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone
SMILESCC[C@@H](O)c1ccccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C15H21NO4/c1-2-13(17)12-5-3-4-6-14(12)20-11-15(18)16-7-9-19-10-8-16/h3-6,13,17H,2,7-11H2,1H3/t13-/m1/s1
InChIKeyKMWPMQSUNYOGSI-CYBMUJFWSA-N
MW279.34 g/mol
LogP1.37
Rot. Bonds5

About 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone

2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone (PubChem CID 78930986) has the molecular formula C15H21NO4 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone
PubChem CID78930986
Molecular FormulaC15H21NO4
Molecular Weight279.34 g/mol
Exact Mass279.15
IUPAC Name2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone
SMILESCC[C@@H](O)c1ccccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C15H21NO4/c1-2-13(17)12-5-3-4-6-14(12)20-11-15(18)16-7-9-19-10-8-16/h3-6,13,17H,2,7-11H2,1H3/t13-/m1/s1
InChIKeyKMWPMQSUNYOGSI-CYBMUJFWSA-N
XLogP1.37
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[(1S)-1-hydroxypropyl]phenoxy]-1-piperidin-1-ylethanone
CID 78930779
2-[2-(1-hydroxypropyl)phenoxy]-1-(4-methylpiperazin-1-yl)ethanone
CID 43503608
2-(2-bromophenoxy)-1-morpholin-4-ylethanone
CID 725441
2-(2-chlorophenoxy)-1-morpholin-4-ylethanone
CID 905479
2-[2-(1-hydroxyethyl)phenoxy]-1-pyrrolidin-1-ylethanone
CID 43504036
1-morpholin-4-yl-2-naphthalen-1-yloxyethanone
CID 954548
ethyl 2-[2-(1-hydroxypropyl)phenoxy]acetate
CID 43503550
2-[4-chloro-2-(1-hydroxyethyl)phenoxy]-1-morpholin-4-ylethanone
CID 62074602
2-[4-chloro-2-[(1S)-1-hydroxyethyl]phenoxy]-1-morpholin-4-ylethanone
CID 78931421
2-[5-fluoro-2-[(1R)-1-hydroxyethyl]phenoxy]-1-morpholin-4-ylethanone
CID 63365946
1-morpholin-4-yl-2-[2-(propylaminomethyl)phenoxy]ethanone
CID 43277297
1-(4-acetylpiperazin-1-yl)-2-(2-propan-2-ylphenoxy)ethanone
CID 112977426

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone (CID 78930986) is 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone is CC[C@@H](O)c1ccccc1OCC(=O)N1CCOCC1.
What is the InChIKey of 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone?
The InChIKey is KMWPMQSUNYOGSI-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21NO4/c1-2-13(17)12-5-3-4-6-14(12)20-11-15(18)16-7-9-19-10-8-16/h3-6,13,17H,2,7-11H2,1H3/t13-/m1/s1.
What are the key properties of 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone?
2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone has a molecular weight of 279.34 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1R)-1-hydroxypropyl]phenoxy]-1-morpholin-4-ylethanone is sourced from PubChem (CID 78930986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).