3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide

C19H23NO2 — CID 127121905

IUPAC3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide
SMILESCOc1cccc(CCC(=O)NCCCc2ccccc2)c1
InChIInChI=1S/C19H23NO2/c1-22-18-11-5-9-17(15-18)12-13-19(21)20-14-6-10-16-7-3-2-4-8-16/h2-5,7-9,11,15H,6,10,12-14H2,1H3,(H,20,21)
InChIKeyHKIVXRPPFIYHRS-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.38
Rot. Bonds8

About 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide

3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide (PubChem CID 127121905) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide
PubChem CID127121905
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide
SMILESCOc1cccc(CCC(=O)NCCCc2ccccc2)c1
InChIInChI=1S/C19H23NO2/c1-22-18-11-5-9-17(15-18)12-13-19(21)20-14-6-10-16-7-3-2-4-8-16/h2-5,7-9,11,15H,6,10,12-14H2,1H3,(H,20,21)
InChIKeyHKIVXRPPFIYHRS-UHFFFAOYSA-N
XLogP3.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-methoxybutyl)-3-(3-methoxyphenyl)propanamide
CID 110418006
3-(2-fluorophenyl)-N-[3-(3-methoxyphenyl)propyl]propanamide
CID 95172563
3-(3-methoxyphenyl)-N-[3-(1-phenylethoxy)propyl]propanamide
CID 134039850
3-(3-methoxyphenyl)-N-[3-[(2,2,2-trifluoroacetyl)amino]propyl]propanamide
CID 108934905
N-[2-(4-aminophenyl)ethyl]-3-(3-methoxyphenyl)propanamide
CID 119549328
2-(4-methoxyphenoxy)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 95172596
4-[2-(3-methoxyphenyl)ethylamino]-4-oxobutanoic acid;hydrochloride
CID 170649983
3-(3-aminophenyl)-N-(3-phenylpropyl)propanamide
CID 28713423
N-[2-(3-methoxyphenyl)ethyl]-4-(methylamino)butanamide
CID 113266225
N-[3-(4-methoxyphenyl)propyl]-3-[(2-phenylacetyl)amino]propanamide
CID 55919627
4-[2-(3-methoxyphenyl)ethyl]-N-(3-phenylpropyl)piperazine-1-carboxamide
CID 113109361
N-(2-hydroxy-3-phenylpropyl)-3-(3-methoxyphenyl)propanamide
CID 111102377

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide?
The IUPAC name of 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide (CID 127121905) is 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide.
What is the SMILES notation for 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide?
The canonical SMILES for 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide is COc1cccc(CCC(=O)NCCCc2ccccc2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide?
The InChIKey is HKIVXRPPFIYHRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-22-18-11-5-9-17(15-18)12-13-19(21)20-14-6-10-16-7-3-2-4-8-16/h2-5,7-9,11,15H,6,10,12-14H2,1H3,(H,20,21).
What are the key properties of 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide?
3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide has a molecular weight of 297.40 g/mol, XLogP of 3.38, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide is sourced from PubChem (CID 127121905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).