N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide

C24H27NO2 — CID 133161421

IUPACN-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide
SMILESCCC(NC(=O)CCc1cccc2ccccc12)c1ccc(OC)c(C)c1
InChIInChI=1S/C24H27NO2/c1-4-22(20-12-14-23(27-3)17(2)16-20)25-24(26)15-13-19-10-7-9-18-8-5-6-11-21(18)19/h5-12,14,16,22H,4,13,15H2,1-3H3,(H,25,26)
InChIKeyOTRXBBYLANMOES-UHFFFAOYSA-N
MW361.49 g/mol
LogP5.36
Rot. Bonds7

About N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide

N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide (PubChem CID 133161421) has the molecular formula C24H27NO2 and a molecular weight of 361.49 g/mol. Its IUPAC name is N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide.

Molecular Properties

Compound NameN-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide
PubChem CID133161421
Molecular FormulaC24H27NO2
Molecular Weight361.49 g/mol
Exact Mass361.20
IUPAC NameN-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide
SMILESCCC(NC(=O)CCc1cccc2ccccc12)c1ccc(OC)c(C)c1
InChIInChI=1S/C24H27NO2/c1-4-22(20-12-14-23(27-3)17(2)16-20)25-24(26)15-13-19-10-7-9-18-8-5-6-11-21(18)19/h5-12,14,16,22H,4,13,15H2,1-3H3,(H,25,26)
InChIKeyOTRXBBYLANMOES-UHFFFAOYSA-N
XLogP5.36
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.49
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3,4-dimethylphenyl)propyl]-3-naphthalen-1-ylpropanamide
CID 132652663
3-(2,6-dichlorophenyl)-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]propanamide
CID 100604900
N-[(1R)-1-(4-methoxy-3-methylphenyl)propyl]-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 100665459
N-[(1R)-1-(4-methoxy-3-methylphenyl)propyl]-2-(4-phenylphenyl)acetamide
CID 100517764
2-(4-ethylphenyl)-N-[(1R)-1-(4-methoxy-3-methylphenyl)propyl]acetamide
CID 100585229
2-(4-ethylphenyl)-N-[1-(4-methoxy-3-methylphenyl)propyl]acetamide
CID 133202725
3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide
CID 133210054
2-(4-chlorophenyl)-N-[1-(4-methoxy-3-methylphenyl)propyl]acetamide
CID 133162635
2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide
CID 133210916
2-(4-methoxy-3-methylphenyl)-N-[1-(4-methoxyphenyl)propyl]acetamide
CID 133200186
N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide
CID 133184843
3-(3,4-dimethoxyphenyl)-3-[3-(2-methoxyphenyl)propanoylamino]propanoic acid
CID 45433011

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide?
The IUPAC name of N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide (CID 133161421) is N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide.
What is the SMILES notation for N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide?
The canonical SMILES for N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide is CCC(NC(=O)CCc1cccc2ccccc12)c1ccc(OC)c(C)c1.
What is the InChIKey of N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide?
The InChIKey is OTRXBBYLANMOES-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27NO2/c1-4-22(20-12-14-23(27-3)17(2)16-20)25-24(26)15-13-19-10-7-9-18-8-5-6-11-21(18)19/h5-12,14,16,22H,4,13,15H2,1-3H3,(H,25,26).
What are the key properties of N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide?
N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide has a molecular weight of 361.49 g/mol, XLogP of 5.36, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxy-3-methylphenyl)propyl]-3-naphthalen-1-ylpropanamide is sourced from PubChem (CID 133161421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).