4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide

C17H25NO4 — CID 133149981

IUPAC4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide
SMILESCCOCc1cc(C(=O)NCC2CCCO2)ccc1OCC
InChIInChI=1S/C17H25NO4/c1-3-20-12-14-10-13(7-8-16(14)21-4-2)17(19)18-11-15-6-5-9-22-15/h7-8,10,15H,3-6,9,11-12H2,1-2H3,(H,18,19)
InChIKeyXPOYMCVQFLOELN-UHFFFAOYSA-N
MW307.39 g/mol
LogP2.53
Rot. Bonds8

About 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide

4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide (PubChem CID 133149981) has the molecular formula C17H25NO4 and a molecular weight of 307.39 g/mol. Its IUPAC name is 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide
PubChem CID133149981
Molecular FormulaC17H25NO4
Molecular Weight307.39 g/mol
Exact Mass307.18
IUPAC Name4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide
SMILESCCOCc1cc(C(=O)NCC2CCCO2)ccc1OCC
InChIInChI=1S/C17H25NO4/c1-3-20-12-14-10-13(7-8-16(14)21-4-2)17(19)18-11-15-6-5-9-22-15/h7-8,10,15H,3-6,9,11-12H2,1-2H3,(H,18,19)
InChIKeyXPOYMCVQFLOELN-UHFFFAOYSA-N
XLogP2.53
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-ethoxy-3-(methoxymethyl)-N-(oxolan-2-ylmethyl)benzamide
CID 133254195
4-ethoxy-N-(oxolan-2-ylmethyl)-3-[(2-propan-2-ylphenoxy)methyl]benzamide
CID 133238905
4-ethoxy-N-(oxolan-2-ylmethyl)benzamide
CID 2850672
3-ethoxy-N-(oxolan-2-ylmethyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 46584168
5-chloro-2-ethoxy-N-(oxolan-2-ylmethyl)benzamide
CID 17297293
4-(2-ethoxyethoxy)-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 41229837
3-chloro-4-methoxy-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 7426624
3-methoxy-N-(oxolan-2-ylmethyl)-4-prop-2-enoxybenzamide
CID 18160322
4-amino-3-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 16789376
2-[2-ethoxy-4-[2-(oxolan-2-yl)ethylcarbamoyl]phenoxy]acetic acid
CID 119180117
1-[[(2S)-oxolan-2-yl]methyl]-3-[(3,4,5-triethoxybenzoyl)amino]thiourea
CID 27000622
2-methoxy-5-(oxolan-2-ylmethylcarbamoyl)benzenesulfonyl chloride
CID 65368575

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide?
The IUPAC name of 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide (CID 133149981) is 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide.
What is the SMILES notation for 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide?
The canonical SMILES for 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide is CCOCc1cc(C(=O)NCC2CCCO2)ccc1OCC.
What is the InChIKey of 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide?
The InChIKey is XPOYMCVQFLOELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO4/c1-3-20-12-14-10-13(7-8-16(14)21-4-2)17(19)18-11-15-6-5-9-22-15/h7-8,10,15H,3-6,9,11-12H2,1-2H3,(H,18,19).
What are the key properties of 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide?
4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide has a molecular weight of 307.39 g/mol, XLogP of 2.53, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-3-(ethoxymethyl)-N-(oxolan-2-ylmethyl)benzamide is sourced from PubChem (CID 133149981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).