N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide

C21H24N2O4 — CID 110367710

IUPACN-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide
SMILESCCc1ccc(N2CC(CNC(=O)c3cccc(OC)c3)OCC2=O)cc1
InChIInChI=1S/C21H24N2O4/c1-3-15-7-9-17(10-8-15)23-13-19(27-14-20(23)24)12-22-21(25)16-5-4-6-18(11-16)26-2/h4-11,19H,3,12-14H2,1-2H3,(H,22,25)
InChIKeyBMIPFDZFJSQJSP-UHFFFAOYSA-N
MW368.43 g/mol
LogP2.42
Rot. Bonds6

About N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide

N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide (PubChem CID 110367710) has the molecular formula C21H24N2O4 and a molecular weight of 368.43 g/mol. Its IUPAC name is N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide
PubChem CID110367710
Molecular FormulaC21H24N2O4
Molecular Weight368.43 g/mol
Exact Mass368.17
IUPAC NameN-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide
SMILESCCc1ccc(N2CC(CNC(=O)c3cccc(OC)c3)OCC2=O)cc1
InChIInChI=1S/C21H24N2O4/c1-3-15-7-9-17(10-8-15)23-13-19(27-14-20(23)24)12-22-21(25)16-5-4-6-18(11-16)26-2/h4-11,19H,3,12-14H2,1-2H3,(H,22,25)
InChIKeyBMIPFDZFJSQJSP-UHFFFAOYSA-N
XLogP2.42
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-3-methylbenzamide
CID 110367545
3-chloro-N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367650
N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-4-methylbenzamide
CID 110367624
3,4-difluoro-N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367657
N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-4-methylbenzamide
CID 110367703
ethyl N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]carbamate
CID 110367661
3-methyl-N-[(5-oxo-4-phenylmorpholin-2-yl)methyl]benzamide
CID 110366956
2-methoxy-N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367630
ethyl N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]carbamate
CID 110367743
2-(4-ethoxyphenyl)-N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]acetamide
CID 110367721
N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]butanamide
CID 110367688
1,1-diethyl-3-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]urea
CID 110367747

Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide?
The IUPAC name of N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide (CID 110367710) is N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide.
What is the SMILES notation for N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide?
The canonical SMILES for N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide is CCc1ccc(N2CC(CNC(=O)c3cccc(OC)c3)OCC2=O)cc1.
What is the InChIKey of N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide?
The InChIKey is BMIPFDZFJSQJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O4/c1-3-15-7-9-17(10-8-15)23-13-19(27-14-20(23)24)12-22-21(25)16-5-4-6-18(11-16)26-2/h4-11,19H,3,12-14H2,1-2H3,(H,22,25).
What are the key properties of N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide?
N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide has a molecular weight of 368.43 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methoxybenzamide is sourced from PubChem (CID 110367710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).