2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide

C22H27NO4 — CID 27448887

IUPAC2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC1(c2ccc(OC)cc2)CCOCC1
InChIInChI=1S/C22H27NO4/c1-3-27-20-7-5-4-6-19(20)21(24)23-16-22(12-14-26-15-13-22)17-8-10-18(25-2)11-9-17/h4-11H,3,12-16H2,1-2H3,(H,23,24)
InChIKeyZHXUTHKDXXQAGN-UHFFFAOYSA-N
MW369.46 g/mol
LogP3.57
Rot. Bonds7

About 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide

2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide (PubChem CID 27448887) has the molecular formula C22H27NO4 and a molecular weight of 369.46 g/mol. Its IUPAC name is 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide
PubChem CID27448887
Molecular FormulaC22H27NO4
Molecular Weight369.46 g/mol
Exact Mass369.19
IUPAC Name2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC1(c2ccc(OC)cc2)CCOCC1
InChIInChI=1S/C22H27NO4/c1-3-27-20-7-5-4-6-19(20)21(24)23-16-22(12-14-26-15-13-22)17-8-10-18(25-2)11-9-17/h4-11H,3,12-16H2,1-2H3,(H,23,24)
InChIKeyZHXUTHKDXXQAGN-UHFFFAOYSA-N
XLogP3.57
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.46
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]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

2-ethoxy-N-[(4-thiophen-2-yloxan-4-yl)methyl]benzamide
CID 30943676
N'-(2-methoxyphenyl)-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]oxamide
CID 7647050
N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-oxo-1H-quinoline-4-carboxamide
CID 71753557
5-bromo-2-chloro-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide
CID 27448908
5-amino-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-2-methylbenzamide
CID 120625700
N-[[4-(4-chlorophenyl)oxan-4-yl]methyl]-2,3-dimethoxybenzamide
CID 27449051
4-chloro-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide
CID 40617546
2-chloro-6-fluoro-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide
CID 27448939
(E)-3-(4-ethoxyphenyl)-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]prop-2-enamide
CID 94650415
4-methoxy-N-[[4-(2-methoxyphenyl)oxan-4-yl]methyl]benzamide
CID 27449238
N-[[4-(4-fluorophenyl)oxan-4-yl]methyl]-2-methylbenzamide
CID 27449958
5-chloro-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]furan-2-carboxamide
CID 86836755

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide?
The IUPAC name of 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide (CID 27448887) is 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide is CCOc1ccccc1C(=O)NCC1(c2ccc(OC)cc2)CCOCC1.
What is the InChIKey of 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide?
The InChIKey is ZHXUTHKDXXQAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO4/c1-3-27-20-7-5-4-6-19(20)21(24)23-16-22(12-14-26-15-13-22)17-8-10-18(25-2)11-9-17/h4-11H,3,12-16H2,1-2H3,(H,23,24).
What are the key properties of 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide?
2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide has a molecular weight of 369.46 g/mol, XLogP of 3.57, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]benzamide is sourced from PubChem (CID 27448887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).