N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide

C20H24N2O4 — CID 17149354

IUPACN-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
SMILESCCCCNC(=O)c1ccccc1NC(=O)COc1ccc(OC)cc1
InChIInChI=1S/C20H24N2O4/c1-3-4-13-21-20(24)17-7-5-6-8-18(17)22-19(23)14-26-16-11-9-15(25-2)10-12-16/h5-12H,3-4,13-14H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyAKDNCPNDEJEDNP-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.24
Rot. Bonds9

About N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide

N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide (PubChem CID 17149354) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
PubChem CID17149354
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
SMILESCCCCNC(=O)c1ccccc1NC(=O)COc1ccc(OC)cc1
InChIInChI=1S/C20H24N2O4/c1-3-4-13-21-20(24)17-7-5-6-8-18(17)22-19(23)14-26-16-11-9-15(25-2)10-12-16/h5-12H,3-4,13-14H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyAKDNCPNDEJEDNP-UHFFFAOYSA-N
XLogP3.24
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-2-[[2-(4-methoxyphenyl)sulfanylacetyl]amino]benzamide
CID 28578361
2-[[2-(4-bromophenoxy)acetyl]amino]-N-propylbenzamide
CID 4945967
N-butyl-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)acetyl]amino]benzamide
CID 100577851
N-(3-ethoxypropyl)-2-[(2-phenoxyacetyl)amino]benzamide
CID 17311898
methyl 3-[2-(butylcarbamoyl)anilino]-3-oxopropanoate
CID 28638069
N-butan-2-yl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
CID 2942479
2-[[2-(3,4-dimethylphenoxy)acetyl]amino]-N-propylbenzamide
CID 4946012
N-butyl-2-[4-(4-chlorophenoxy)butanoylamino]benzamide
CID 21367326
N,N'-bis[2-(butylcarbamoyl)phenyl]hexanediamide
CID 17149668
2-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]-N-butylbenzamide
CID 17149335
N-(2-methoxyethyl)-2-[[2-(3-methoxyphenoxy)acetyl]amino]benzamide
CID 94595466
2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 29446930

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide?
The IUPAC name of N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide (CID 17149354) is N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide.
What is the SMILES notation for N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide?
The canonical SMILES for N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide is CCCCNC(=O)c1ccccc1NC(=O)COc1ccc(OC)cc1.
What is the InChIKey of N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide?
The InChIKey is AKDNCPNDEJEDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-3-4-13-21-20(24)17-7-5-6-8-18(17)22-19(23)14-26-16-11-9-15(25-2)10-12-16/h5-12H,3-4,13-14H2,1-2H3,(H,21,24)(H,22,23).
What are the key properties of N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide?
N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide has a molecular weight of 356.42 g/mol, XLogP of 3.24, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide is sourced from PubChem (CID 17149354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).