3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide

C19H22N2O4 — CID 2109722

IUPAC3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N[C@@H](C)c2ccccc2)c1
InChIInChI=1S/C19H22N2O4/c1-13(14-7-5-4-6-8-14)21-18(22)12-20-19(23)15-9-16(24-2)11-17(10-15)25-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)/t13-/m0/s1
InChIKeyKCPQWEIJKSDUMS-ZDUSSCGKSA-N
MW342.40 g/mol
LogP2.31
Rot. Bonds7

About 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide

3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide (PubChem CID 2109722) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide
PubChem CID2109722
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N[C@@H](C)c2ccccc2)c1
InChIInChI=1S/C19H22N2O4/c1-13(14-7-5-4-6-8-14)21-18(22)12-20-19(23)15-9-16(24-2)11-17(10-15)25-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)/t13-/m0/s1
InChIKeyKCPQWEIJKSDUMS-ZDUSSCGKSA-N
XLogP2.31
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]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

Troxipide
CID 5597
N-(1-benzylpiperidin-4-yl)-3,5-dimethoxybenzamide
CID 14514271
4-(3,5-Dimethoxybenzoyl)-1,3-dihydroquinoxalin-2-one
CID 2420253
3-Methoxy-N-piperidin-4-yl-benzamide
CID 1445157
3-methoxy-N-(4-phenylbutan-2-yl)benzamide
CID 2914414
3,5-dimethoxy-N-(4-phenylbutan-2-yl)benzamide
CID 2915995
Tricetamide
CID 67763
N-Benzyl-3,4,5-trimethoxybenzamide
CID 736962
N-benzhydryl-3,5-dimethoxybenzamide
CID 873122
3-(difluoromethoxy)-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
CID 2105607
3-methoxy-N-[(1-piperidin-1-ylcyclohexyl)methyl]benzamide
CID 2462542
2,4-dimethoxy-N-(4-phenylbutan-2-yl)benzamide
CID 2902442

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide (CID 2109722) is 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide is COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H](C)c2ccccc2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide?
The InChIKey is KCPQWEIJKSDUMS-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13(14-7-5-4-6-8-14)21-18(22)12-20-19(23)15-9-16(24-2)11-17(10-15)25-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)/t13-/m0/s1.
What are the key properties of 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide?
3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide has a molecular weight of 342.40 g/mol, XLogP of 2.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide is sourced from PubChem (CID 2109722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).