3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide

C20H24N2O4 — CID 18114048

IUPAC3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N(C)Cc2ccccc2C)c1
InChIInChI=1S/C20H24N2O4/c1-14-7-5-6-8-15(14)13-22(2)19(23)12-21-20(24)16-9-17(25-3)11-18(10-16)26-4/h5-11H,12-13H2,1-4H3,(H,21,24)
InChIKeyZRVMVDYBRUJENQ-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.40
Rot. Bonds7

About 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide

3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide (PubChem CID 18114048) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide
PubChem CID18114048
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N(C)Cc2ccccc2C)c1
InChIInChI=1S/C20H24N2O4/c1-14-7-5-6-8-15(14)13-22(2)19(23)12-21-20(24)16-9-17(25-3)11-18(10-16)26-4/h5-11H,12-13H2,1-4H3,(H,21,24)
InChIKeyZRVMVDYBRUJENQ-UHFFFAOYSA-N
XLogP2.40
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl] 3,5-dimethoxybenzoate
CID 7727298
4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 134028521
N-[2-[(2-fluorophenyl)methyl-methylamino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 31138692
3,5-dimethoxy-N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]benzamide
CID 9219213
N-[2-[(2-chlorophenyl)methyl-methylamino]-2-oxoethyl]-3,4-dimethoxybenzamide
CID 17480746
N-[2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]benzamide
CID 24544434
3-[methyl-[(2-methylphenyl)methyl]amino]-3-oxopropanoic acid
CID 62231590
methyl 4-[methyl-[(2-methylphenyl)methyl]carbamoyl]benzoate
CID 9368938
2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 16769161
3,5-dimethoxy-N-(2-oxopropyl)benzamide
CID 64996551
N-[2-[(2,3-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]-4-phenylbenzamide
CID 9166749
N-[(2-chlorophenyl)methyl]-3,5-dimethoxybenzamide
CID 881091

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide (CID 18114048) is 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide is COc1cc(OC)cc(C(=O)NCC(=O)N(C)Cc2ccccc2C)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide?
The InChIKey is ZRVMVDYBRUJENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-14-7-5-6-8-15(14)13-22(2)19(23)12-21-20(24)16-9-17(25-3)11-18(10-16)26-4/h5-11H,12-13H2,1-4H3,(H,21,24).
What are the key properties of 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide?
3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide has a molecular weight of 356.42 g/mol, XLogP of 2.40, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 18114048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).