3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide

C22H26N2O5 — CID 25162715

IUPAC3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide
SMILESCOc1cc(C(=O)NC(C)c2ccccc2)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C22H26N2O5/c1-16(17-6-4-3-5-7-17)23-22(26)18-8-9-19(20(14-18)27-2)29-15-21(25)24-10-12-28-13-11-24/h3-9,14,16H,10-13,15H2,1-2H3,(H,23,26)
InChIKeyYUBKOVLDCAWRRG-UHFFFAOYSA-N
MW398.46 g/mol
LogP2.42
Rot. Bonds7

About 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide

3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide (PubChem CID 25162715) has the molecular formula C22H26N2O5 and a molecular weight of 398.46 g/mol. Its IUPAC name is 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide
PubChem CID25162715
Molecular FormulaC22H26N2O5
Molecular Weight398.46 g/mol
Exact Mass398.18
IUPAC Name3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide
SMILESCOc1cc(C(=O)NC(C)c2ccccc2)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C22H26N2O5/c1-16(17-6-4-3-5-7-17)23-22(26)18-8-9-19(20(14-18)27-2)29-15-21(25)24-10-12-28-13-11-24/h3-9,14,16H,10-13,15H2,1-2H3,(H,23,26)
InChIKeyYUBKOVLDCAWRRG-UHFFFAOYSA-N
XLogP2.42
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.46
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide?
The IUPAC name of 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide (CID 25162715) is 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide?
The canonical SMILES for 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide is COc1cc(C(=O)NC(C)c2ccccc2)ccc1OCC(=O)N1CCOCC1.
What is the InChIKey of 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide?
The InChIKey is YUBKOVLDCAWRRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O5/c1-16(17-6-4-3-5-7-17)23-22(26)18-8-9-19(20(14-18)27-2)29-15-21(25)24-10-12-28-13-11-24/h3-9,14,16H,10-13,15H2,1-2H3,(H,23,26).
What are the key properties of 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide?
3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide has a molecular weight of 398.46 g/mol, XLogP of 2.42, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 25162715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).