2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide

C18H20N2O5 — CID 17403518

IUPAC2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
SMILESCNC(=O)c1cccc(NC(=O)c2cc(OC)c(OC)cc2OC)c1
InChIInChI=1S/C18H20N2O5/c1-19-17(21)11-6-5-7-12(8-11)20-18(22)13-9-15(24-3)16(25-4)10-14(13)23-2/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyJBOWWGHGPDZJMS-UHFFFAOYSA-N
MW344.37 g/mol
LogP2.32
Rot. Bonds6

About 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide

2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide (PubChem CID 17403518) has the molecular formula C18H20N2O5 and a molecular weight of 344.37 g/mol. Its IUPAC name is 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
PubChem CID17403518
Molecular FormulaC18H20N2O5
Molecular Weight344.37 g/mol
Exact Mass344.14
IUPAC Name2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
SMILESCNC(=O)c1cccc(NC(=O)c2cc(OC)c(OC)cc2OC)c1
InChIInChI=1S/C18H20N2O5/c1-19-17(21)11-6-5-7-12(8-11)20-18(22)13-9-15(24-3)16(25-4)10-14(13)23-2/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyJBOWWGHGPDZJMS-UHFFFAOYSA-N
XLogP2.32
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-benzamidophenyl)-2,4,5-trimethoxybenzamide
CID 55797225
2,4,5-trimethoxy-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 4793592
4-bromo-3,5-dimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 37007263
N-[3-(ethylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 17439182
N-[3-(dimethylsulfamoyl)phenyl]-2,4,5-trimethoxybenzamide
CID 9093791
2-benzamido-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 112767345
3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17471157
3-[(2,4-dimethoxybenzoyl)amino]benzoate
CID 7375040
3-chloro-4-ethoxy-5-methoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17470046
N-(3,5-dimethoxyphenyl)-2,4,5-trimethoxybenzamide
CID 2200296
3-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]-N-methylbenzamide
CID 134050295
2,4,5-trimethoxy-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 131950606

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide?
The IUPAC name of 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide (CID 17403518) is 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide is CNC(=O)c1cccc(NC(=O)c2cc(OC)c(OC)cc2OC)c1.
What is the InChIKey of 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide?
The InChIKey is JBOWWGHGPDZJMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5/c1-19-17(21)11-6-5-7-12(8-11)20-18(22)13-9-15(24-3)16(25-4)10-14(13)23-2/h5-10H,1-4H3,(H,19,21)(H,20,22).
What are the key properties of 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide?
2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide has a molecular weight of 344.37 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethoxy-N-[3-(methylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 17403518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).