2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide

C23H25NO5 — CID 132660138

IUPAC2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CNC(=O)C(C)Oc2cccc3ccccc23)c(OC)c1OC
InChIInChI=1S/C23H25NO5/c1-15(29-19-11-7-9-16-8-5-6-10-18(16)19)23(25)24-14-17-12-13-20(26-2)22(28-4)21(17)27-3/h5-13,15H,14H2,1-4H3,(H,24,25)
InChIKeyKFKUDAWTZPAVQH-UHFFFAOYSA-N
MW395.46 g/mol
LogP3.95
Rot. Bonds8

About 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide

2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide (PubChem CID 132660138) has the molecular formula C23H25NO5 and a molecular weight of 395.46 g/mol. Its IUPAC name is 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
PubChem CID132660138
Molecular FormulaC23H25NO5
Molecular Weight395.46 g/mol
Exact Mass395.17
IUPAC Name2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CNC(=O)C(C)Oc2cccc3ccccc23)c(OC)c1OC
InChIInChI=1S/C23H25NO5/c1-15(29-19-11-7-9-16-8-5-6-10-18(16)19)23(25)24-14-17-12-13-20(26-2)22(28-4)21(17)27-3/h5-13,15H,14H2,1-4H3,(H,24,25)
InChIKeyKFKUDAWTZPAVQH-UHFFFAOYSA-N
XLogP3.95
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-propan-2-ylphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 43876908
2-(2-chlorophenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 132656973
(2S)-2-(4-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 94049685
2-(3-methoxyphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 43910190
(2R)-N-[(2-ethoxyphenyl)methyl]-2-naphthalen-1-yloxypropanamide
CID 94015852
2-(2,3-dimethylphenoxy)-N-(naphthalen-1-ylmethyl)propanamide
CID 133218986
N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 18425632
N-[(2,3-dimethoxyphenyl)methyl]naphthalene-1-carboxamide
CID 46590604
N-ethyl-2-[2-(hydroxymethyl)-6-methoxyphenoxy]propanamide
CID 43471524
N-(naphthalen-1-ylmethyl)-2-naphthalen-1-yloxybutanamide
CID 133218992
(2R)-2-(2,4-dimethylphenoxy)-N-[(2-methoxyphenyl)methyl]propanamide
CID 124561460
2-(3-methylphenoxy)-N-(naphthalen-1-ylmethyl)propanamide
CID 133218956

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The IUPAC name of 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide (CID 132660138) is 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide.
What is the SMILES notation for 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The canonical SMILES for 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide is COc1ccc(CNC(=O)C(C)Oc2cccc3ccccc23)c(OC)c1OC.
What is the InChIKey of 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
The InChIKey is KFKUDAWTZPAVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO5/c1-15(29-19-11-7-9-16-8-5-6-10-18(16)19)23(25)24-14-17-12-13-20(26-2)22(28-4)21(17)27-3/h5-13,15H,14H2,1-4H3,(H,24,25).
What are the key properties of 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide?
2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide has a molecular weight of 395.46 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide is sourced from PubChem (CID 132660138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).