2,5-dimethoxy-N-methyl-N-phenylbenzamide

C16H17NO3 — CID 16849123

IUPAC2,5-dimethoxy-N-methyl-N-phenylbenzamide
SMILESCOc1ccc(OC)c(C(=O)N(C)c2ccccc2)c1
InChIInChI=1S/C16H17NO3/c1-17(12-7-5-4-6-8-12)16(18)14-11-13(19-2)9-10-15(14)20-3/h4-11H,1-3H3
InChIKeyXOSGUHMXWWGKRI-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.98
Rot. Bonds4

About 2,5-dimethoxy-N-methyl-N-phenylbenzamide

2,5-dimethoxy-N-methyl-N-phenylbenzamide (PubChem CID 16849123) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2,5-dimethoxy-N-methyl-N-phenylbenzamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-methyl-N-phenylbenzamide
PubChem CID16849123
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name2,5-dimethoxy-N-methyl-N-phenylbenzamide
SMILESCOc1ccc(OC)c(C(=O)N(C)c2ccccc2)c1
InChIInChI=1S/C16H17NO3/c1-17(12-7-5-4-6-8-12)16(18)14-11-13(19-2)9-10-15(14)20-3/h4-11H,1-3H3
InChIKeyXOSGUHMXWWGKRI-UHFFFAOYSA-N
XLogP2.98
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-4-methoxy-N-methyl-N-phenylbenzamide
CID 39963889
2,5-dimethoxy-N-methyl-N-(1-phenylethyl)benzamide
CID 43022056
2,3,4-trimethoxy-N-methyl-N-phenylbenzamide
CID 51161127
2,5-dimethoxy-N-[1-(2-methoxyphenyl)ethyl]-N-methylbenzamide
CID 74627130
N-(2,5-dimethoxyphenyl)-N'-methyl-N'-phenylpropanediamide
CID 108953194
5-(2,5-dimethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197597
3-hydroxy-4-methoxy-N-methyl-N-phenylbenzamide
CID 79725609
2-N-(2,5-dimethoxyphenyl)-4-N-methyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109091438
4-[[2-(2,5-dimethoxyanilino)acetyl]amino]-N-methyl-N-phenylbenzamide
CID 54814112
2,5-dimethoxy-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylbenzamide
CID 43024651
N-(1-hydroxypropan-2-yl)-2,5-dimethoxy-N-methylbenzamide
CID 112704642
1-N-(2,5-dimethoxyphenyl)-1-N'-methyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108980986

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-methyl-N-phenylbenzamide?
The IUPAC name of 2,5-dimethoxy-N-methyl-N-phenylbenzamide (CID 16849123) is 2,5-dimethoxy-N-methyl-N-phenylbenzamide.
What is the SMILES notation for 2,5-dimethoxy-N-methyl-N-phenylbenzamide?
The canonical SMILES for 2,5-dimethoxy-N-methyl-N-phenylbenzamide is COc1ccc(OC)c(C(=O)N(C)c2ccccc2)c1.
What is the InChIKey of 2,5-dimethoxy-N-methyl-N-phenylbenzamide?
The InChIKey is XOSGUHMXWWGKRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-17(12-7-5-4-6-8-12)16(18)14-11-13(19-2)9-10-15(14)20-3/h4-11H,1-3H3.
What are the key properties of 2,5-dimethoxy-N-methyl-N-phenylbenzamide?
2,5-dimethoxy-N-methyl-N-phenylbenzamide has a molecular weight of 271.32 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-methyl-N-phenylbenzamide is sourced from PubChem (CID 16849123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).