N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide

C20H25NO3 — CID 71508235

IUPACN-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide
SMILESCCC(=O)NCCCc1cc(OC)ccc1-c1cccc(OC)c1
InChIInChI=1S/C20H25NO3/c1-4-20(22)21-12-6-8-16-14-18(24-3)10-11-19(16)15-7-5-9-17(13-15)23-2/h5,7,9-11,13-14H,4,6,8,12H2,1-3H3,(H,21,22)
InChIKeyZNOFYIUJRHQQNE-UHFFFAOYSA-N
MW327.42 g/mol
LogP3.83
Rot. Bonds8

About N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide

N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide (PubChem CID 71508235) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide.

Molecular Properties

Compound NameN-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide
PubChem CID71508235
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC NameN-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide
SMILESCCC(=O)NCCCc1cc(OC)ccc1-c1cccc(OC)c1
InChIInChI=1S/C20H25NO3/c1-4-20(22)21-12-6-8-16-14-18(24-3)10-11-19(16)15-7-5-9-17(13-15)23-2/h5,7,9-11,13-14H,4,6,8,12H2,1-3H3,(H,21,22)
InChIKeyZNOFYIUJRHQQNE-UHFFFAOYSA-N
XLogP3.83
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide?
The IUPAC name of N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide (CID 71508235) is N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide.
What is the SMILES notation for N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide?
The canonical SMILES for N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide is CCC(=O)NCCCc1cc(OC)ccc1-c1cccc(OC)c1.
What is the InChIKey of N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide?
The InChIKey is ZNOFYIUJRHQQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-4-20(22)21-12-6-8-16-14-18(24-3)10-11-19(16)15-7-5-9-17(13-15)23-2/h5,7,9-11,13-14H,4,6,8,12H2,1-3H3,(H,21,22).
What are the key properties of N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide?
N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide has a molecular weight of 327.42 g/mol, XLogP of 3.83, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-methoxy-2-(3-methoxyphenyl)phenyl]propyl]propanamide is sourced from PubChem (CID 71508235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).