N-[3-(3-phenoxyphenyl)propyl]propanamide

C18H21NO2 — CID 58062216

IUPACN-[3-(3-phenoxyphenyl)propyl]propanamide
SMILESCCC(=O)NCCCc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C18H21NO2/c1-2-18(20)19-13-7-9-15-8-6-12-17(14-15)21-16-10-4-3-5-11-16/h3-6,8,10-12,14H,2,7,9,13H2,1H3,(H,19,20)
InChIKeyDDIVUDOFLAZPGN-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.94
Rot. Bonds7

About N-[3-(3-phenoxyphenyl)propyl]propanamide

N-[3-(3-phenoxyphenyl)propyl]propanamide (PubChem CID 58062216) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[3-(3-phenoxyphenyl)propyl]propanamide.

Molecular Properties

Compound NameN-[3-(3-phenoxyphenyl)propyl]propanamide
PubChem CID58062216
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[3-(3-phenoxyphenyl)propyl]propanamide
SMILESCCC(=O)NCCCc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C18H21NO2/c1-2-18(20)19-13-7-9-15-8-6-12-17(14-15)21-16-10-4-3-5-11-16/h3-6,8,10-12,14H,2,7,9,13H2,1H3,(H,19,20)
InChIKeyDDIVUDOFLAZPGN-UHFFFAOYSA-N
XLogP3.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.94
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

dipotassium;hydride;[2-oxo-2-[3-(3-phenoxyphenyl)propylamino]ethyl]phosphonic acid
CID 173007799
3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide
CID 127121905
[1-amino-1,3-dioxo-3-[3-(3-phenoxyphenyl)propylamino]propan-2-yl]phosphonic acid
CID 66680025
N-[3-(3-phenoxyphenyl)propyl]nitrous amide
CID 19736886
1-phenoxy-3-(3-phenylpropyl)benzene
CID 173282204
2-(3-phenylmethoxyphenyl)ethanamine;N-[2-(3-phenylmethoxyphenyl)ethyl]propanamide
CID 159272620
N-[3-[3-(4-chlorophenoxy)phenyl]propyl]-2-phosphonatoacetamide
CID 91935111
dipotassium;N-[3-[3-(4-chlorophenoxy)phenyl]propyl]-2-phosphonatoacetamide
CID 58062257
2-(4-methoxyphenoxy)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 95172596
1-phenoxy-3-[2-(3-phenoxyphenyl)ethyl]benzene
CID 3046200
2-(2,5-dimethylphenyl)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 38002281
2-[[2-(3-phenoxyphenyl)acetyl]amino]propanoic acid
CID 162228691

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-phenoxyphenyl)propyl]propanamide?
The IUPAC name of N-[3-(3-phenoxyphenyl)propyl]propanamide (CID 58062216) is N-[3-(3-phenoxyphenyl)propyl]propanamide.
What is the SMILES notation for N-[3-(3-phenoxyphenyl)propyl]propanamide?
The canonical SMILES for N-[3-(3-phenoxyphenyl)propyl]propanamide is CCC(=O)NCCCc1cccc(Oc2ccccc2)c1.
What is the InChIKey of N-[3-(3-phenoxyphenyl)propyl]propanamide?
The InChIKey is DDIVUDOFLAZPGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-2-18(20)19-13-7-9-15-8-6-12-17(14-15)21-16-10-4-3-5-11-16/h3-6,8,10-12,14H,2,7,9,13H2,1H3,(H,19,20).
What are the key properties of N-[3-(3-phenoxyphenyl)propyl]propanamide?
N-[3-(3-phenoxyphenyl)propyl]propanamide has a molecular weight of 283.37 g/mol, XLogP of 3.94, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-phenoxyphenyl)propyl]propanamide is sourced from PubChem (CID 58062216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).