N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide

C26H29NO5 — CID 55871682

IUPACN-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccc(OCc3ccccc3)cc2)c(OC)c1OC
InChIInChI=1S/C26H29NO5/c1-29-23-15-11-21(25(30-2)26(23)31-3)12-16-24(28)27-17-19-9-13-22(14-10-19)32-18-20-7-5-4-6-8-20/h4-11,13-15H,12,16-18H2,1-3H3,(H,27,28)
InChIKeyGRDPUMOLPYFCDL-UHFFFAOYSA-N
MW435.52 g/mol
LogP4.54
Rot. Bonds11

About N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide

N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide (PubChem CID 55871682) has the molecular formula C26H29NO5 and a molecular weight of 435.52 g/mol. Its IUPAC name is N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide.

Molecular Properties

Compound NameN-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide
PubChem CID55871682
Molecular FormulaC26H29NO5
Molecular Weight435.52 g/mol
Exact Mass435.20
IUPAC NameN-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccc(OCc3ccccc3)cc2)c(OC)c1OC
InChIInChI=1S/C26H29NO5/c1-29-23-15-11-21(25(30-2)26(23)31-3)12-16-24(28)27-17-19-9-13-22(14-10-19)32-18-20-7-5-4-6-8-20/h4-11,13-15H,12,16-18H2,1-3H3,(H,27,28)
InChIKeyGRDPUMOLPYFCDL-UHFFFAOYSA-N
XLogP4.54
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.52
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]-3-(2,3,4-trimethoxyphenyl)propanamide
CID 55880789
3-phenyl-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 46587581
N-(2-phenoxyethyl)-3-(2,3,4-trimethoxyphenyl)propanamide
CID 55882512
N-[(3,5-dimethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide
CID 55870487
N-benzyl-3-[(2,3,4-trimethoxyphenyl)methylamino]propanamide
CID 51129427
2-[3-(2,3,4-trimethoxyphenyl)propanoylamino]acetic acid
CID 119171700
N-[(3-phenylmethoxyphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)propanamide
CID 55843576
N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]butanamide
CID 27865842
N-[[4-[2-(ethylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl]-3-(2,3,4-trimethoxyphenyl)propanamide
CID 55881030
3-(2-chloro-5-methoxy-4-phenylmethoxyphenyl)-N-[(4-chlorophenyl)methyl]propanamide
CID 58655143
2-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide
CID 46586786
2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide
CID 27865855

Frequently Asked Questions

What is the IUPAC name of N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide?
The IUPAC name of N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide (CID 55871682) is N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide.
What is the SMILES notation for N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide?
The canonical SMILES for N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide is COc1ccc(CCC(=O)NCc2ccc(OCc3ccccc3)cc2)c(OC)c1OC.
What is the InChIKey of N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide?
The InChIKey is GRDPUMOLPYFCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO5/c1-29-23-15-11-21(25(30-2)26(23)31-3)12-16-24(28)27-17-19-9-13-22(14-10-19)32-18-20-7-5-4-6-8-20/h4-11,13-15H,12,16-18H2,1-3H3,(H,27,28).
What are the key properties of N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide?
N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide has a molecular weight of 435.52 g/mol, XLogP of 4.54, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-phenylmethoxyphenyl)methyl]-3-(2,3,4-trimethoxyphenyl)propanamide is sourced from PubChem (CID 55871682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).