3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide

C19H22N2O3 — CID 17222629

IUPAC3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(NC(=O)Cc2ccc(OC)cc2)c1
InChIInChI=1S/C19H22N2O3/c1-3-11-20-19(23)15-5-4-6-16(13-15)21-18(22)12-14-7-9-17(24-2)10-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyPAFXUYGHJKRORE-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.02
Rot. Bonds7

About 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide

3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide (PubChem CID 17222629) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide.

Molecular Properties

Compound Name3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide
PubChem CID17222629
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide
SMILESCCCNC(=O)c1cccc(NC(=O)Cc2ccc(OC)cc2)c1
InChIInChI=1S/C19H22N2O3/c1-3-11-20-19(23)15-5-4-6-16(13-15)21-18(22)12-14-7-9-17(24-2)10-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyPAFXUYGHJKRORE-UHFFFAOYSA-N
XLogP3.02
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-[[2-(4-methoxyphenyl)acetyl]amino]benzamide
CID 17230663
N-butyl-3-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
CID 17196943
N-(furan-2-ylmethyl)-3-[[2-(4-methoxyphenyl)acetyl]amino]benzamide
CID 17199915
3-[[2-(4-aminophenyl)acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 54795721
N-[3-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-2-(4-methoxyphenyl)acetamide
CID 24702333
2-[[3-[[2-(4-methoxyphenyl)acetyl]amino]benzoyl]amino]benzoic acid
CID 1321809
3-[[2-(4-methoxyphenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43877752
3-[(2-aminoacetyl)amino]-N-propylbenzamide;hydrochloride
CID 119283116
3-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-(3-methoxypropyl)benzamide
CID 54837826
2-(4-methoxyphenyl)-N-(3-propoxyphenyl)acetamide
CID 17096682
3-[[2-(4-chlorophenyl)acetyl]amino]-N-ethylbenzamide
CID 17230707
3-[3-(4-methoxyphenyl)propanoylamino]-N-methylbenzamide
CID 17439563

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide?
The IUPAC name of 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide (CID 17222629) is 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide.
What is the SMILES notation for 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide?
The canonical SMILES for 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide is CCCNC(=O)c1cccc(NC(=O)Cc2ccc(OC)cc2)c1.
What is the InChIKey of 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide?
The InChIKey is PAFXUYGHJKRORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-11-20-19(23)15-5-4-6-16(13-15)21-18(22)12-14-7-9-17(24-2)10-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide?
3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide has a molecular weight of 326.40 g/mol, XLogP of 3.02, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(4-methoxyphenyl)acetyl]amino]-N-propylbenzamide is sourced from PubChem (CID 17222629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).