N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide

C19H28N2O5 — CID 162799400

IUPACN-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide
SMILESCOCC1CCCN1CC1OCC(NC(=O)COc2ccccc2)C1O
InChIInChI=1S/C19H28N2O5/c1-24-11-14-6-5-9-21(14)10-17-19(23)16(12-26-17)20-18(22)13-25-15-7-3-2-4-8-15/h2-4,7-8,14,16-17,19,23H,5-6,9-13H2,1H3,(H,20,22)
InChIKeyBPMWGEYNDZQEQE-UHFFFAOYSA-N
MW364.44 g/mol
LogP0.42
Rot. Bonds8

About N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide

N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide (PubChem CID 162799400) has the molecular formula C19H28N2O5 and a molecular weight of 364.44 g/mol. Its IUPAC name is N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide
PubChem CID162799400
Molecular FormulaC19H28N2O5
Molecular Weight364.44 g/mol
Exact Mass364.20
IUPAC NameN-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide
SMILESCOCC1CCCN1CC1OCC(NC(=O)COc2ccccc2)C1O
InChIInChI=1S/C19H28N2O5/c1-24-11-14-6-5-9-21(14)10-17-19(23)16(12-26-17)20-18(22)13-25-15-7-3-2-4-8-15/h2-4,7-8,14,16-17,19,23H,5-6,9-13H2,1H3,(H,20,22)
InChIKeyBPMWGEYNDZQEQE-UHFFFAOYSA-N
XLogP0.42
TPSA80.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.44
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]oxane-4-carboxamide
CID 162804971
N-[(1R,2R,3R)-2,3-dihydroxycyclohexyl]-2-phenoxyacetamide
CID 110164138
N-[(3S,4R,5S)-5-[(4-acetylpiperazin-1-yl)methyl]-4-hydroxyoxolan-3-yl]-2-methoxyacetamide
CID 125417765
(2S)-2-(methoxymethyl)-1-(3-phenoxypropyl)pyrrolidine
CID 141200367
N-(6-methyloxan-3-yl)-2-phenoxyacetamide
CID 155627872
N-(oxan-3-yl)-2-phenoxyacetamide
CID 142540024
1-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-phenoxyethanone
CID 81483948
1-[(2R)-2-(methylaminomethyl)pyrrolidin-1-yl]-2-phenoxyethanone
CID 124569777
4-hydroxy-3-[(2-phenoxyacetyl)amino]piperidine-1-carboxylic acid
CID 123895994
N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-(4-phenylphenoxy)acetamide
CID 9087672
N-[5-[(4,4-difluoropiperidin-1-yl)methyl]-4-hydroxyoxolan-3-yl]-2-phenylacetamide
CID 162844857
N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-2-(4-phenylphenoxy)acetamide
CID 9087674

Frequently Asked Questions

What is the IUPAC name of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide?
The IUPAC name of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide (CID 162799400) is N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide.
What is the SMILES notation for N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide?
The canonical SMILES for N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide is COCC1CCCN1CC1OCC(NC(=O)COc2ccccc2)C1O.
What is the InChIKey of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide?
The InChIKey is BPMWGEYNDZQEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O5/c1-24-11-14-6-5-9-21(14)10-17-19(23)16(12-26-17)20-18(22)13-25-15-7-3-2-4-8-15/h2-4,7-8,14,16-17,19,23H,5-6,9-13H2,1H3,(H,20,22).
What are the key properties of N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide?
N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide has a molecular weight of 364.44 g/mol, XLogP of 0.42, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-hydroxy-5-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]oxolan-3-yl]-2-phenoxyacetamide is sourced from PubChem (CID 162799400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).