2,6-dimethoxy-3-phenylbenzamide

C15H15NO3 — CID 68897697

IUPAC2,6-dimethoxy-3-phenylbenzamide
SMILESCOc1ccc(-c2ccccc2)c(OC)c1C(N)=O
InChIInChI=1S/C15H15NO3/c1-18-12-9-8-11(10-6-4-3-5-7-10)14(19-2)13(12)15(16)17/h3-9H,1-2H3,(H2,16,17)
InChIKeyIAAQVCUMAMJMSR-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.47
Rot. Bonds4

About 2,6-dimethoxy-3-phenylbenzamide

2,6-dimethoxy-3-phenylbenzamide (PubChem CID 68897697) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2,6-dimethoxy-3-phenylbenzamide.

Molecular Properties

Compound Name2,6-dimethoxy-3-phenylbenzamide
PubChem CID68897697
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name2,6-dimethoxy-3-phenylbenzamide
SMILESCOc1ccc(-c2ccccc2)c(OC)c1C(N)=O
InChIInChI=1S/C15H15NO3/c1-18-12-9-8-11(10-6-4-3-5-7-10)14(19-2)13(12)15(16)17/h3-9H,1-2H3,(H2,16,17)
InChIKeyIAAQVCUMAMJMSR-UHFFFAOYSA-N
XLogP2.47
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethoxy-3-phenylbenzoic acid
CID 68897922
methyl 2,6-dimethoxy-3-phenylbenzoate
CID 142664398
2,6-dimethoxy-3-phenylbenzoyl chloride
CID 141166869
3-(2,3,4-trimethoxyphenyl)benzamide
CID 174562773
4,5-dimethoxy-2-phenylbenzamide
CID 141317116
2,3-dimethoxy-4-phenylbenzoic acid
CID 22633208
6,7-dimethoxy-1,4-diphenylnaphthalene
CID 134090814
2,3-dimethoxy-4-phenylbenzoyl chloride
CID 18351428
adamantane;tris(1,2,3-trimethoxy-4-phenylbenzene)
CID 175349946
2-methoxy-1,3-diphenylbenzene
CID 23524590
1-[4-(2,6-dimethoxy-3-phenylphenyl)phenyl]-2,2,2-trifluoroethanone
CID 42638415
4-(2,3,4-trimethoxyphenyl)cyclohepta-2,4,6-trien-1-one
CID 15011206

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-3-phenylbenzamide?
The IUPAC name of 2,6-dimethoxy-3-phenylbenzamide (CID 68897697) is 2,6-dimethoxy-3-phenylbenzamide.
What is the SMILES notation for 2,6-dimethoxy-3-phenylbenzamide?
The canonical SMILES for 2,6-dimethoxy-3-phenylbenzamide is COc1ccc(-c2ccccc2)c(OC)c1C(N)=O.
What is the InChIKey of 2,6-dimethoxy-3-phenylbenzamide?
The InChIKey is IAAQVCUMAMJMSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-18-12-9-8-11(10-6-4-3-5-7-10)14(19-2)13(12)15(16)17/h3-9H,1-2H3,(H2,16,17).
What are the key properties of 2,6-dimethoxy-3-phenylbenzamide?
2,6-dimethoxy-3-phenylbenzamide has a molecular weight of 257.29 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-3-phenylbenzamide is sourced from PubChem (CID 68897697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).