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

C21H27NO2 — CID 133210054

IUPAC3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide
SMILESCCC(NC(=O)CCc1ccc(OC)c(C)c1)c1ccc(C)cc1
InChIInChI=1S/C21H27NO2/c1-5-19(18-10-6-15(2)7-11-18)22-21(23)13-9-17-8-12-20(24-4)16(3)14-17/h6-8,10-12,14,19H,5,9,13H2,1-4H3,(H,22,23)
InChIKeyNHHCAWULAKECMB-UHFFFAOYSA-N
MW325.45 g/mol
LogP4.51
Rot. Bonds7

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

3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide (PubChem CID 133210054) has the molecular formula C21H27NO2 and a molecular weight of 325.45 g/mol. Its IUPAC name is 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide.

Molecular Properties

Compound Name3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide
PubChem CID133210054
Molecular FormulaC21H27NO2
Molecular Weight325.45 g/mol
Exact Mass325.20
IUPAC Name3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide
SMILESCCC(NC(=O)CCc1ccc(OC)c(C)c1)c1ccc(C)cc1
InChIInChI=1S/C21H27NO2/c1-5-19(18-10-6-15(2)7-11-18)22-21(23)13-9-17-8-12-20(24-4)16(3)14-17/h6-8,10-12,14,19H,5,9,13H2,1-4H3,(H,22,23)
InChIKeyNHHCAWULAKECMB-UHFFFAOYSA-N
XLogP4.51
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.45
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4-dimethylphenyl)-N-[(1S)-1-(4-methylphenyl)propyl]propanamide
CID 100549740
3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylsulfonylphenyl)propyl]propanamide
CID 133158339
2-(4-methoxy-3-methylphenyl)-N-[1-(4-methoxyphenyl)propyl]acetamide
CID 133200186
3-(4-methoxy-3-methylphenyl)-N-[1-(4-methoxyphenyl)-3-methylbutyl]propanamide
CID 133210929
2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide
CID 133210916
3-(3,4-dichlorophenyl)-N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]propanamide
CID 100597392
N-(2,4-dimethylpentan-3-yl)-3-(4-methoxy-3-methylphenyl)propanamide
CID 100749422
3-(4-methylphenyl)-N-[(1R)-1-phenylpropyl]propanamide
CID 92675135
2-(3,4-dimethylphenyl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 132760177
3-(2,6-dichlorophenyl)-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]propanamide
CID 100604900
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

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide?
The IUPAC name of 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide (CID 133210054) is 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide.
What is the SMILES notation for 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide?
The canonical SMILES for 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide is CCC(NC(=O)CCc1ccc(OC)c(C)c1)c1ccc(C)cc1.
What is the InChIKey of 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide?
The InChIKey is NHHCAWULAKECMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO2/c1-5-19(18-10-6-15(2)7-11-18)22-21(23)13-9-17-8-12-20(24-4)16(3)14-17/h6-8,10-12,14,19H,5,9,13H2,1-4H3,(H,22,23).
What are the key properties of 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide?
3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide has a molecular weight of 325.45 g/mol, XLogP of 4.51, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxy-3-methylphenyl)-N-[1-(4-methylphenyl)propyl]propanamide is sourced from PubChem (CID 133210054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).