3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide

C20H25NO2 — CID 17321844

IUPAC3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide
SMILESCCCN(C(=O)CCc1ccc(OC)cc1)c1cccc(C)c1
InChIInChI=1S/C20H25NO2/c1-4-14-21(18-7-5-6-16(2)15-18)20(22)13-10-17-8-11-19(23-3)12-9-17/h5-9,11-12,15H,4,10,13-14H2,1-3H3
InChIKeyJQYVOOLILOZMHB-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.38
Rot. Bonds7

About 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide

3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide (PubChem CID 17321844) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide
PubChem CID17321844
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide
SMILESCCCN(C(=O)CCc1ccc(OC)cc1)c1cccc(C)c1
InChIInChI=1S/C20H25NO2/c1-4-14-21(18-7-5-6-16(2)15-18)20(22)13-10-17-8-11-19(23-3)12-9-17/h5-9,11-12,15H,4,10,13-14H2,1-3H3
InChIKeyJQYVOOLILOZMHB-UHFFFAOYSA-N
XLogP4.38
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide (CID 17321844) is 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide is CCCN(C(=O)CCc1ccc(OC)cc1)c1cccc(C)c1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide?
The InChIKey is JQYVOOLILOZMHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-4-14-21(18-7-5-6-16(2)15-18)20(22)13-10-17-8-11-19(23-3)12-9-17/h5-9,11-12,15H,4,10,13-14H2,1-3H3.
What are the key properties of 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide?
3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide has a molecular weight of 311.43 g/mol, XLogP of 4.38, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide is sourced from PubChem (CID 17321844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).