7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione

C26H34N2O8 — CID 11016587

IUPAC7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione
SMILESCOc1ccccc1N1CCOCCOCCN(c2ccccc2OC)C(=O)COCCOCC1=O
InChIInChI=1S/C26H34N2O8/c1-31-23-9-5-3-7-21(23)27-11-13-33-15-16-34-14-12-28(22-8-4-6-10-24(22)32-2)26(30)20-36-18-17-35-19-25(27)29/h3-10H,11-20H2,1-2H3
InChIKeyDGNNNKNRUNRFBX-UHFFFAOYSA-N
MW502.56 g/mol
LogP2.15
Rot. Bonds4

About 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione

7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione (PubChem CID 11016587) has the molecular formula C26H34N2O8 and a molecular weight of 502.56 g/mol. Its IUPAC name is 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione.

Molecular Properties

Compound Name7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione
PubChem CID11016587
Molecular FormulaC26H34N2O8
Molecular Weight502.56 g/mol
Exact Mass502.23
IUPAC Name7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione
SMILESCOc1ccccc1N1CCOCCOCCN(c2ccccc2OC)C(=O)COCCOCC1=O
InChIInChI=1S/C26H34N2O8/c1-31-23-9-5-3-7-21(23)27-11-13-33-15-16-34-14-12-28(22-8-4-6-10-24(22)32-2)26(30)20-36-18-17-35-19-25(27)29/h3-10H,11-20H2,1-2H3
InChIKeyDGNNNKNRUNRFBX-UHFFFAOYSA-N
XLogP2.15
TPSA96.00 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500502.56
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione with MolForge

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Related Compounds

4-(2-methoxy-4-methylphenyl)morpholin-3-one
CID 165482194
16-(2-methoxyphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 86134682
7,16-diphenyl-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione
CID 12887277
1-(2-methoxyphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
CID 18886001
4-(3,4,5-trimethoxyphenyl)morpholin-3-one
CID 165481703
2-methoxy-4-(3-oxomorpholin-4-yl)benzaldehyde
CID 91756333
4-(3-chloro-2-methylphenyl)morpholin-3-one
CID 165473298
[2-(3-oxomorpholin-4-yl)phenyl]methyl acetate
CID 174792483
4-(2-propan-2-ylsulfonylphenyl)morpholin-3-one
CID 165482191
1-(2-methoxyphenyl)-4-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 55340090
4-(2-methoxyphenyl)-2-methyl-5-oxomorpholine-2-carboxylic acid
CID 115068184
1-(2-methoxyphenyl)-3-[2-(morpholin-4-ylmethyl)anilino]pyrrolidin-2-one
CID 126781578

Frequently Asked Questions

What is the IUPAC name of 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione?
The IUPAC name of 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione (CID 11016587) is 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione.
What is the SMILES notation for 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione?
The canonical SMILES for 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione is COc1ccccc1N1CCOCCOCCN(c2ccccc2OC)C(=O)COCCOCC1=O.
What is the InChIKey of 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione?
The InChIKey is DGNNNKNRUNRFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N2O8/c1-31-23-9-5-3-7-21(23)27-11-13-33-15-16-34-14-12-28(22-8-4-6-10-24(22)32-2)26(30)20-36-18-17-35-19-25(27)29/h3-10H,11-20H2,1-2H3.
What are the key properties of 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione?
7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione has a molecular weight of 502.56 g/mol, XLogP of 2.15, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7,16-bis(2-methoxyphenyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione is sourced from PubChem (CID 11016587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).