4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide

C18H26N2O4 — CID 51098454

IUPAC4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccc(C(=O)NCC(=O)N(CC)CC2CCOC2)cc1
InChIInChI=1S/C18H26N2O4/c1-3-20(12-14-9-10-23-13-14)17(21)11-19-18(22)15-5-7-16(8-6-15)24-4-2/h5-8,14H,3-4,9-13H2,1-2H3,(H,19,22)
InChIKeyVUKBVMNGXFISLA-UHFFFAOYSA-N
MW334.42 g/mol
LogP1.70
Rot. Bonds8

About 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide

4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide (PubChem CID 51098454) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide
PubChem CID51098454
Molecular FormulaC18H26N2O4
Molecular Weight334.42 g/mol
Exact Mass334.19
IUPAC Name4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccc(C(=O)NCC(=O)N(CC)CC2CCOC2)cc1
InChIInChI=1S/C18H26N2O4/c1-3-20(12-14-9-10-23-13-14)17(21)11-19-18(22)15-5-7-16(8-6-15)24-4-2/h5-8,14H,3-4,9-13H2,1-2H3,(H,19,22)
InChIKeyVUKBVMNGXFISLA-UHFFFAOYSA-N
XLogP1.70
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[ethyl-[[(3S)-oxolan-3-yl]methyl]amino]-2-oxoethyl]-4-fluorobenzamide
CID 94820192
N-[2-[ethyl-[[(3S)-oxolan-3-yl]methyl]amino]-2-oxoethyl]-3,4-dimethylbenzamide
CID 94823366
1-(4-ethoxyphenyl)-2-(oxolan-3-yl)ethanone
CID 103986239
3-(3-aminophenoxy)-N-ethyl-N-(oxolan-3-ylmethyl)propanamide
CID 61114635
N-ethyl-N-[[(3S)-oxolan-3-yl]methyl]-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 94186944
N-ethyl-2-(3-methoxyphenyl)-N-[[(3S)-oxolan-3-yl]methyl]acetamide
CID 94186811
4-ethoxy-N-ethyl-N-(piperidin-4-ylmethyl)benzamide
CID 79698338
4-ethoxy-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 27258304
(4-ethoxyphenyl)-(oxolan-3-yl)methanone
CID 61272590
N-ethyl-2-(N-ethylanilino)-N-(oxolan-3-ylmethyl)acetamide
CID 51097037
4-(dimethylsulfamoyl)-N-ethyl-N-[[(3S)-oxolan-3-yl]methyl]benzamide
CID 94805874
3-amino-N-ethyl-4-methoxy-N-(oxolan-3-ylmethyl)benzamide
CID 61115387

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide (CID 51098454) is 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide is CCOc1ccc(C(=O)NCC(=O)N(CC)CC2CCOC2)cc1.
What is the InChIKey of 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide?
The InChIKey is VUKBVMNGXFISLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4/c1-3-20(12-14-9-10-23-13-14)17(21)11-19-18(22)15-5-7-16(8-6-15)24-4-2/h5-8,14H,3-4,9-13H2,1-2H3,(H,19,22).
What are the key properties of 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide?
4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide has a molecular weight of 334.42 g/mol, XLogP of 1.70, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[2-[ethyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 51098454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).