2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide

C23H28N2O4 — CID 126785089

IUPAC2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
SMILESO=C(CN1CCOC2(CCOC2)C1)NCc1ccccc1COc1ccccc1
InChIInChI=1S/C23H28N2O4/c26-22(15-25-11-13-29-23(17-25)10-12-27-18-23)24-14-19-6-4-5-7-20(19)16-28-21-8-2-1-3-9-21/h1-9H,10-18H2,(H,24,26)
InChIKeyFBGPULFANXUCMS-UHFFFAOYSA-N
MW396.49 g/mol
LogP2.37
Rot. Bonds7

About 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide

2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide (PubChem CID 126785089) has the molecular formula C23H28N2O4 and a molecular weight of 396.49 g/mol. Its IUPAC name is 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
PubChem CID126785089
Molecular FormulaC23H28N2O4
Molecular Weight396.49 g/mol
Exact Mass396.20
IUPAC Name2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
SMILESO=C(CN1CCOC2(CCOC2)C1)NCc1ccccc1COc1ccccc1
InChIInChI=1S/C23H28N2O4/c26-22(15-25-11-13-29-23(17-25)10-12-27-18-23)24-14-19-6-4-5-7-20(19)16-28-21-8-2-1-3-9-21/h1-9H,10-18H2,(H,24,26)
InChIKeyFBGPULFANXUCMS-UHFFFAOYSA-N
XLogP2.37
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide with MolForge

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Related Compounds

N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]acetamide
CID 60503666
2-(2,4-dioxopyrimidin-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
CID 17398844
1-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-3-(3-phenoxypropyl)urea
CID 36524900
N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]-2-(phenoxymethyl)benzamide
CID 29357190
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[[4-(phenoxymethyl)phenyl]methyl]acetamide
CID 120774440
2-bromo-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 63679084
1-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-3-[2-(phenoxymethyl)phenyl]urea
CID 126771061
2-[cyclopentyl(methyl)amino]-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
CID 112840926
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-(4-propanoylphenoxy)acetamide
CID 51207835
2-(2-ethylbenzimidazol-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
CID 17417716
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-phenylmethoxyacetamide
CID 134015077
N-methyl-2-[4-(pyridine-2-carbonyl)-1,11-dioxa-4,8-diazaspiro[5.6]dodecan-8-yl]acetamide
CID 134072875

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide (CID 126785089) is 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide is O=C(CN1CCOC2(CCOC2)C1)NCc1ccccc1COc1ccccc1.
What is the InChIKey of 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
The InChIKey is FBGPULFANXUCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O4/c26-22(15-25-11-13-29-23(17-25)10-12-27-18-23)24-14-19-6-4-5-7-20(19)16-28-21-8-2-1-3-9-21/h1-9H,10-18H2,(H,24,26).
What are the key properties of 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide?
2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide has a molecular weight of 396.49 g/mol, XLogP of 2.37, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dioxa-9-azaspiro[4.5]decan-9-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 126785089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).