3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide

C20H24N2O3 — CID 17222669

IUPAC3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(NC(=O)C(C)Oc2cccc(C)c2)c1
InChIInChI=1S/C20H24N2O3/c1-4-11-21-20(24)16-8-6-9-17(13-16)22-19(23)15(3)25-18-10-5-7-14(2)12-18/h5-10,12-13,15H,4,11H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyYBYAPXWFRPHFSS-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.54
Rot. Bonds7

About 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide

3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide (PubChem CID 17222669) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide.

Molecular Properties

Compound Name3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide
PubChem CID17222669
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(NC(=O)C(C)Oc2cccc(C)c2)c1
InChIInChI=1S/C20H24N2O3/c1-4-11-21-20(24)16-8-6-9-17(13-16)22-19(23)15(3)25-18-10-5-7-14(2)12-18/h5-10,12-13,15H,4,11H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyYBYAPXWFRPHFSS-UHFFFAOYSA-N
XLogP3.54
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxyethyl)-3-[2-(3-methylphenoxy)propanoylamino]benzamide
CID 17218985
4-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide
CID 17218775
3-[2-(4-propan-2-ylphenoxy)propanoylamino]-N-propylbenzamide
CID 17222714
(2R)-2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 7946484
2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 4931056
N-butyl-3-[2-(4-methoxyphenoxy)propanoylamino]benzamide
CID 17196958
3-[2-(4-methylphenoxy)propanoylamino]-N-(3-methylphenyl)benzamide
CID 43877477
N-(3-ethoxyphenyl)-2-(3-methylphenoxy)propanamide
CID 17098138
N-(2-methylpropyl)-3-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 976970
3-[(2-amino-3-methylbutanoyl)amino]-N-propylbenzamide
CID 43700232
3-[[(2R)-2-amino-3-methylbutanoyl]amino]-N-propylbenzamide
CID 79011822
3-[2-(4-chlorophenoxy)propanoylamino]-N-(3-methylphenyl)benzamide
CID 43877483

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide?
The IUPAC name of 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide (CID 17222669) is 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide.
What is the SMILES notation for 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide?
The canonical SMILES for 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide is CCCNC(=O)c1cccc(NC(=O)C(C)Oc2cccc(C)c2)c1.
What is the InChIKey of 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide?
The InChIKey is YBYAPXWFRPHFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-11-21-20(24)16-8-6-9-17(13-16)22-19(23)15(3)25-18-10-5-7-14(2)12-18/h5-10,12-13,15H,4,11H2,1-3H3,(H,21,24)(H,22,23).
What are the key properties of 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide?
3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide has a molecular weight of 340.42 g/mol, XLogP of 3.54, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-methylphenoxy)propanoylamino]-N-propylbenzamide is sourced from PubChem (CID 17222669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).