4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide

C21H33N3O4 — CID 55520878

IUPAC4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccc(C(=O)NCC(=O)NCC(CC(C)C)N2CCOCC2)cc1
InChIInChI=1S/C21H33N3O4/c1-4-28-19-7-5-17(6-8-19)21(26)23-15-20(25)22-14-18(13-16(2)3)24-9-11-27-12-10-24/h5-8,16,18H,4,9-15H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyGVYKRKAWCMJLCH-UHFFFAOYSA-N
MW391.51 g/mol
LogP1.68
Rot. Bonds10

About 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide

4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide (PubChem CID 55520878) has the molecular formula C21H33N3O4 and a molecular weight of 391.51 g/mol. Its IUPAC name is 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
PubChem CID55520878
Molecular FormulaC21H33N3O4
Molecular Weight391.51 g/mol
Exact Mass391.25
IUPAC Name4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccc(C(=O)NCC(=O)NCC(CC(C)C)N2CCOCC2)cc1
InChIInChI=1S/C21H33N3O4/c1-4-28-19-7-5-17(6-8-19)21(26)23-15-20(25)22-14-18(13-16(2)3)24-9-11-27-12-10-24/h5-8,16,18H,4,9-15H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyGVYKRKAWCMJLCH-UHFFFAOYSA-N
XLogP1.68
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.51
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
CID 46541190
N-(4-methyl-2-morpholin-4-ylpentyl)-2-(4-propanoylphenoxy)acetamide
CID 18157786
4-(difluoromethoxy)-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027068
3-fluoro-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
CID 78840417
2-(4-ethoxyphenyl)-N-(4-methyl-2-pyrrolidin-1-ylpentyl)acetamide
CID 110403492
2-(4-fluorophenoxy)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 134027111
4-ethoxy-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 27258304
2-ethoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027029
2-(4-ethoxyphenyl)-4-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-1,3-thiazole-5-carboxamide
CID 55608193
6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 43050246
2-(cyclopropylamino)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 61249539
6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 134027027

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide (CID 55520878) is 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide is CCOc1ccc(C(=O)NCC(=O)NCC(CC(C)C)N2CCOCC2)cc1.
What is the InChIKey of 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
The InChIKey is GVYKRKAWCMJLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O4/c1-4-28-19-7-5-17(6-8-19)21(26)23-15-20(25)22-14-18(13-16(2)3)24-9-11-27-12-10-24/h5-8,16,18H,4,9-15H2,1-3H3,(H,22,25)(H,23,26).
What are the key properties of 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide?
4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide has a molecular weight of 391.51 g/mol, XLogP of 1.68, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 55520878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).