3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide

C24H25NO5 — CID 9456400

IUPAC3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide
SMILESCOc1cccc(CNC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1
InChIInChI=1S/C24H25NO5/c1-27-20-11-7-10-18(12-20)15-25-24(26)19-13-21(28-2)23(22(14-19)29-3)30-16-17-8-5-4-6-9-17/h4-14H,15-16H2,1-3H3,(H,25,26)
InChIKeyVIEUDTRXGXFEJO-UHFFFAOYSA-N
MW407.47 g/mol
LogP4.22
Rot. Bonds9

About 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide

3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide (PubChem CID 9456400) has the molecular formula C24H25NO5 and a molecular weight of 407.47 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide
PubChem CID9456400
Molecular FormulaC24H25NO5
Molecular Weight407.47 g/mol
Exact Mass407.17
IUPAC Name3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide
SMILESCOc1cccc(CNC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1
InChIInChI=1S/C24H25NO5/c1-27-20-11-7-10-18(12-20)15-25-24(26)19-13-21(28-2)23(22(14-19)29-3)30-16-17-8-5-4-6-9-17/h4-14H,15-16H2,1-3H3,(H,25,26)
InChIKeyVIEUDTRXGXFEJO-UHFFFAOYSA-N
XLogP4.22
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dimethoxy-N-[2-(4-methoxyphenoxy)ethyl]-4-phenylmethoxybenzamide
CID 41443073
N-(2-aminoethyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 119384512
3,5-dimethoxy-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-phenylmethoxybenzamide
CID 38123236
4-[(3-methoxyphenyl)methylcarbamoyl]benzoic acid
CID 61028664
3,5-diamino-N-[(3-methoxyphenyl)methyl]benzamide
CID 61102924
3-ethoxy-4-methoxy-N-[(3-methoxyphenyl)methyl]benzamide
CID 38652199
N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 24512905
N-[(3,4-dimethoxyphenyl)methyl]-4-(phenoxymethyl)benzamide
CID 112789277
3,4,5-trimethoxy-N-[(3-pyridin-2-yloxyphenyl)methyl]benzamide
CID 90596216
2-[3-[[(3,5-dimethoxy-4-methylbenzoyl)amino]methyl]phenoxy]acetic acid
CID 119246780
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 27760684
2-(3-methoxyphenyl)-N-[(2-phenylmethoxy-4-pyridinyl)methyl]acetamide
CID 55707019

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide?
The IUPAC name of 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide (CID 9456400) is 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide?
The canonical SMILES for 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide is COc1cccc(CNC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide?
The InChIKey is VIEUDTRXGXFEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO5/c1-27-20-11-7-10-18(12-20)15-25-24(26)19-13-21(28-2)23(22(14-19)29-3)30-16-17-8-5-4-6-9-17/h4-14H,15-16H2,1-3H3,(H,25,26).
What are the key properties of 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide?
3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide has a molecular weight of 407.47 g/mol, XLogP of 4.22, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-4-phenylmethoxybenzamide is sourced from PubChem (CID 9456400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).