3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide

C19H22N2O4 — CID 112999073

IUPAC3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C19H22N2O4/c1-13(2)25-16-9-7-15(8-10-16)21-18(22)12-20-19(23)14-5-4-6-17(11-14)24-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyFUBDMHPRMRJVLR-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.85
Rot. Bonds7

About 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide

3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide (PubChem CID 112999073) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide
PubChem CID112999073
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C19H22N2O4/c1-13(2)25-16-9-7-15(8-10-16)21-18(22)12-20-19(23)14-5-4-6-17(11-14)24-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyFUBDMHPRMRJVLR-UHFFFAOYSA-N
XLogP2.85
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 ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)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

3-methyl-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide
CID 112999065
methyl 4-[[2-[(3-methoxybenzoyl)amino]acetyl]amino]benzoate
CID 26583191
N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]pyridine-3-carboxamide
CID 110705497
N'-(3-methoxyphenyl)-N-(4-propan-2-yloxyphenyl)propanediamide
CID 108955570
N-[2-(3,5-dichloroanilino)-2-oxoethyl]-3-methoxybenzamide
CID 46745605
3-methyl-N-[4-[[2-(4-propan-2-yloxyanilino)acetyl]amino]phenyl]benzamide
CID 54822485
N-[2-(3-methoxyanilino)-2-oxoethyl]-3-methylbenzamide
CID 4679398
2-[[2-[(3-propan-2-yloxybenzoyl)amino]acetyl]amino]acetic acid
CID 62919115
N-(3-methoxypropyl)-3-[[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]amino]benzamide
CID 54842246
3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
CID 46756320
3-methoxy-N-[4-(2-methylpropylamino)phenyl]benzamide
CID 112980344
2-(3-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54829870

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide?
The IUPAC name of 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide (CID 112999073) is 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide?
The canonical SMILES for 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide is COc1cccc(C(=O)NCC(=O)Nc2ccc(OC(C)C)cc2)c1.
What is the InChIKey of 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide?
The InChIKey is FUBDMHPRMRJVLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13(2)25-16-9-7-15(8-10-16)21-18(22)12-20-19(23)14-5-4-6-17(11-14)24-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide?
3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide has a molecular weight of 342.40 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide is sourced from PubChem (CID 112999073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).