4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide

C19H23NO3 — CID 28558287

IUPAC4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide
SMILESCCOc1ccc(C(=O)N[C@@H](C)c2ccccc2OC)cc1C
InChIInChI=1S/C19H23NO3/c1-5-23-17-11-10-15(12-13(17)2)19(21)20-14(3)16-8-6-7-9-18(16)22-4/h6-12,14H,5H2,1-4H3,(H,20,21)/t14-/m0/s1
InChIKeyYYTKGKNTKKOYFJ-AWEZNQCLSA-N
MW313.40 g/mol
LogP3.89
Rot. Bonds6

About 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide

4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide (PubChem CID 28558287) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide.

Molecular Properties

Compound Name4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide
PubChem CID28558287
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide
SMILESCCOc1ccc(C(=O)N[C@@H](C)c2ccccc2OC)cc1C
InChIInChI=1S/C19H23NO3/c1-5-23-17-11-10-15(12-13(17)2)19(21)20-14(3)16-8-6-7-9-18(16)22-4/h6-12,14H,5H2,1-4H3,(H,20,21)/t14-/m0/s1
InChIKeyYYTKGKNTKKOYFJ-AWEZNQCLSA-N
XLogP3.89
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide 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-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 133209826
3-fluoro-4-methoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]benzamide
CID 27787598
N-[1-(2,5-dimethoxyphenyl)ethyl]-4-methoxy-3-methylbenzamide
CID 133160272
4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide
CID 40950006
N-[(1S)-1-(4-bromophenyl)ethyl]-4-ethoxy-3-methylbenzamide
CID 28558276
N-[1-(2-methoxy-5-methylphenyl)ethyl]-3,4-dimethylbenzamide
CID 84966349
N-[(1R)-1-(2-methoxyphenyl)ethyl]-4-propoxybenzamide
CID 26882953
4-ethoxy-N-[1-(4-methoxyphenoxy)propan-2-yl]-3-methylbenzamide
CID 133161789
4-ethoxy-3-methyl-N-[(1S)-1-(4-methylsulfanylphenyl)ethyl]benzamide
CID 28558297
N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-3,4-dimethylbenzamide
CID 9477021
3,4-diethoxy-N-(1-phenylethyl)benzamide
CID 3369950
3,5-dimethoxy-4-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 112762358

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide?
The IUPAC name of 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide (CID 28558287) is 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide.
What is the SMILES notation for 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide?
The canonical SMILES for 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide is CCOc1ccc(C(=O)N[C@@H](C)c2ccccc2OC)cc1C.
What is the InChIKey of 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide?
The InChIKey is YYTKGKNTKKOYFJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H23NO3/c1-5-23-17-11-10-15(12-13(17)2)19(21)20-14(3)16-8-6-7-9-18(16)22-4/h6-12,14H,5H2,1-4H3,(H,20,21)/t14-/m0/s1.
What are the key properties of 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide?
4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide has a molecular weight of 313.40 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide is sourced from PubChem (CID 28558287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).