3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide

C19H22N2O5 — CID 17191665

IUPAC3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCCC(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C19H22N2O5/c1-24-14-10-13(11-15(12-14)25-2)19(23)20-9-8-18(22)21-16-6-4-5-7-17(16)26-3/h4-7,10-12H,8-9H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyRUOFYDYWEPIPRE-UHFFFAOYSA-N
MW358.39 g/mol
LogP2.47
Rot. Bonds8

About 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide

3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide (PubChem CID 17191665) has the molecular formula C19H22N2O5 and a molecular weight of 358.39 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide
PubChem CID17191665
Molecular FormulaC19H22N2O5
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC Name3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCCC(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C19H22N2O5/c1-24-14-10-13(11-15(12-14)25-2)19(23)20-9-8-18(22)21-16-6-4-5-7-17(16)26-3/h4-7,10-12H,8-9H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyRUOFYDYWEPIPRE-UHFFFAOYSA-N
XLogP2.47
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[3-[(3,5-dimethoxybenzoyl)amino]propanoylamino]benzoate
CID 17191696
N-(3-anilino-3-oxopropyl)-3,5-dimethoxybenzamide
CID 17191598
N-[3-(3,5-dimethoxyanilino)-3-oxopropyl]benzamide
CID 9096644
N-[4-(2-methoxyanilino)-4-oxobutyl]benzamide
CID 29371184
N-[3-(4-fluoroanilino)-3-oxopropyl]-3,5-dimethoxybenzamide
CID 17191634
N-[3-(2,5-dimethoxyanilino)-3-oxopropyl]-2-methoxybenzamide
CID 28918895
3,5-dimethoxy-N-[3-(2-methyl-3-nitroanilino)-3-oxopropyl]benzamide
CID 17191720
N-(2-methoxyphenyl)-3-(methylamino)propanamide
CID 54773589
N-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]benzamide
CID 9098271
2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
CID 17226172
N-[3-(2-methoxyanilino)-3-oxopropyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 56744558
N-[3-(5-chloro-2-methoxyanilino)-3-oxopropyl]benzamide
CID 8763306

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide (CID 17191665) is 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide is COc1cc(OC)cc(C(=O)NCCC(=O)Nc2ccccc2OC)c1.
What is the InChIKey of 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide?
The InChIKey is RUOFYDYWEPIPRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5/c1-24-14-10-13(11-15(12-14)25-2)19(23)20-9-8-18(22)21-16-6-4-5-7-17(16)26-3/h4-7,10-12H,8-9H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide?
3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide has a molecular weight of 358.39 g/mol, XLogP of 2.47, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[3-(2-methoxyanilino)-3-oxopropyl]benzamide is sourced from PubChem (CID 17191665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).