2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide

C18H20N2O3 — CID 46745823

IUPAC2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide
SMILESCOc1ccccc1C(=O)NC(C)C(=O)Nc1ccccc1C
InChIInChI=1S/C18H20N2O3/c1-12-8-4-6-10-15(12)20-17(21)13(2)19-18(22)14-9-5-7-11-16(14)23-3/h4-11,13H,1-3H3,(H,19,22)(H,20,21)
InChIKeySJVIYCKSKVGVJP-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.76
Rot. Bonds5

About 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide

2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide (PubChem CID 46745823) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide
PubChem CID46745823
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide
SMILESCOc1ccccc1C(=O)NC(C)C(=O)Nc1ccccc1C
InChIInChI=1S/C18H20N2O3/c1-12-8-4-6-10-15(12)20-17(21)13(2)19-18(22)14-9-5-7-11-16(14)23-3/h4-11,13H,1-3H3,(H,19,22)(H,20,21)
InChIKeySJVIYCKSKVGVJP-UHFFFAOYSA-N
XLogP2.76
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(5-fluoro-2-methoxyanilino)-1-oxopropan-2-yl]-2-methylbenzamide
CID 134351040
2-fluoro-N-[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl]benzamide
CID 51606040
N-[(2R)-1-(4-fluoro-2-methylanilino)-1-oxopropan-2-yl]-2-methylbenzamide
CID 51605145
2-methoxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 18111879
N-[(2S)-1-(4-methoxyanilino)-1-oxopropan-2-yl]-2-methylbenzamide
CID 92664875
2-(4,5-dimethoxy-2-methylanilino)-N-(2-methylphenyl)propanamide
CID 51168758
2-ethoxy-N-[(2S)-3-methyl-1-(2-methylanilino)-1-oxobutan-2-yl]benzamide
CID 2599057
[1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate
CID 16565676
2-methoxy-N-[(3S)-4-methylpent-1-yn-3-yl]benzamide
CID 167135250
2-(carbamoylamino)-N-(2-methoxyphenyl)propanamide
CID 47097666
N-(2,5-dimethylphenyl)-2-(2-methoxyanilino)propanamide
CID 46747955
2-methoxy-N-[(2S)-3-methylbutan-2-yl]benzamide
CID 94867704

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide?
The IUPAC name of 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide (CID 46745823) is 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide.
What is the SMILES notation for 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide?
The canonical SMILES for 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide is COc1ccccc1C(=O)NC(C)C(=O)Nc1ccccc1C.
What is the InChIKey of 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide?
The InChIKey is SJVIYCKSKVGVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-12-8-4-6-10-15(12)20-17(21)13(2)19-18(22)14-9-5-7-11-16(14)23-3/h4-11,13H,1-3H3,(H,19,22)(H,20,21).
What are the key properties of 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide?
2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide has a molecular weight of 312.37 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(2-methylanilino)-1-oxopropan-2-yl]benzamide is sourced from PubChem (CID 46745823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).