N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide

C19H23NO3 — CID 46469470

IUPACN-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide
SMILESCOc1cccc(COC(C)C(=O)Nc2cc(C)cc(C)c2)c1
InChIInChI=1S/C19H23NO3/c1-13-8-14(2)10-17(9-13)20-19(21)15(3)23-12-16-6-5-7-18(11-16)22-4/h5-11,15H,12H2,1-4H3,(H,20,21)
InChIKeyPTAFOWBJCVFVHN-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.86
Rot. Bonds6

About N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide

N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide (PubChem CID 46469470) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide
PubChem CID46469470
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide
SMILESCOc1cccc(COC(C)C(=O)Nc2cc(C)cc(C)c2)c1
InChIInChI=1S/C19H23NO3/c1-13-8-14(2)10-17(9-13)20-19(21)15(3)23-12-16-6-5-7-18(11-16)22-4/h5-11,15H,12H2,1-4H3,(H,20,21)
InChIKeyPTAFOWBJCVFVHN-UHFFFAOYSA-N
XLogP3.86
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[3-(ethylaminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]propanamide
CID 124570178
3-[4-[2-[(3-methoxyphenyl)methoxy]propanoylamino]phenyl]-2-methylpropanoic acid
CID 120540630
2-[4-[2-[(3-methoxyphenyl)methoxy]propanoylamino]phenyl]-2-methylpropanoic acid
CID 119253837
(2S)-2-[(3-methoxyphenyl)methoxy]-N-quinolin-3-ylpropanamide
CID 38938953
N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-2-[(3-methoxyphenyl)methoxy]propanamide
CID 86986127
2-[(3-methoxyphenyl)methoxy]-N-(2,3,4-trifluorophenyl)propanamide
CID 86985434
2-[(3-methoxyphenyl)methoxy]-N-(2-phenoxyphenyl)propanamide
CID 46450815
2-[2-[(3-methoxyphenyl)methoxy]propanoylamino]-N-propan-2-ylbenzamide
CID 60552955
(2S,3S)-2-[2-[(3-methoxyphenyl)methoxy]propanoylamino]-3-methylpentanoic acid
CID 119193748
methyl 5-[[(2R)-2-[(3-methoxyphenyl)methoxy]propanoyl]amino]thiophene-2-carboxylate
CID 38934348
N-(3,5-dimethylphenyl)-N-ethyl-2-[(3-methoxyphenyl)methoxy]propanamide
CID 55965541
N-(3-aminobutyl)-2-[(3-methoxyphenyl)methoxy]propanamide;hydrochloride
CID 119497040

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide (CID 46469470) is N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide is COc1cccc(COC(C)C(=O)Nc2cc(C)cc(C)c2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide?
The InChIKey is PTAFOWBJCVFVHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-13-8-14(2)10-17(9-13)20-19(21)15(3)23-12-16-6-5-7-18(11-16)22-4/h5-11,15H,12H2,1-4H3,(H,20,21).
What are the key properties of N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide?
N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide has a molecular weight of 313.40 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methoxy]propanamide is sourced from PubChem (CID 46469470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).