2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide

C17H19NO5 — CID 7741659

IUPAC2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
SMILESCOc1ccccc1C(=O)Nc1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)17(19)18-11-9-14(21-2)16(23-4)15(10-11)22-3/h5-10H,1-4H3,(H,18,19)
InChIKeyKUUILLCHWRHBFQ-UHFFFAOYSA-N
MW317.34 g/mol
LogP2.97
Rot. Bonds6

About 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide

2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide (PubChem CID 7741659) has the molecular formula C17H19NO5 and a molecular weight of 317.34 g/mol. Its IUPAC name is 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
PubChem CID7741659
Molecular FormulaC17H19NO5
Molecular Weight317.34 g/mol
Exact Mass317.13
IUPAC Name2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
SMILESCOc1ccccc1C(=O)Nc1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)17(19)18-11-9-14(21-2)16(23-4)15(10-11)22-3/h5-10H,1-4H3,(H,18,19)
InChIKeyKUUILLCHWRHBFQ-UHFFFAOYSA-N
XLogP2.97
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide?
The IUPAC name of 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide (CID 7741659) is 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide.
What is the SMILES notation for 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide?
The canonical SMILES for 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide is COc1ccccc1C(=O)Nc1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide?
The InChIKey is KUUILLCHWRHBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO5/c1-20-13-8-6-5-7-12(13)17(19)18-11-9-14(21-2)16(23-4)15(10-11)22-3/h5-10H,1-4H3,(H,18,19).
What are the key properties of 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide?
2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide has a molecular weight of 317.34 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide is sourced from PubChem (CID 7741659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).