2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide

C20H25N3O3 — CID 60508723

IUPAC2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide
SMILESCCCCN(CC(N)=O)CC(=O)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C20H25N3O3/c1-2-3-12-23(14-19(21)24)15-20(25)22-16-8-7-11-18(13-16)26-17-9-5-4-6-10-17/h4-11,13H,2-3,12,14-15H2,1H3,(H2,21,24)(H,22,25)
InChIKeyFLPVCVUVANZPLW-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.00
Rot. Bonds10

About 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide

2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide (PubChem CID 60508723) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide.

Molecular Properties

Compound Name2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide
PubChem CID60508723
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide
SMILESCCCCN(CC(N)=O)CC(=O)Nc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C20H25N3O3/c1-2-3-12-23(14-19(21)24)15-20(25)22-16-8-7-11-18(13-16)26-17-9-5-4-6-10-17/h4-11,13H,2-3,12,14-15H2,1H3,(H2,21,24)(H,22,25)
InChIKeyFLPVCVUVANZPLW-UHFFFAOYSA-N
XLogP3.00
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl(2-hydroxyethyl)amino]-N-(3-phenoxyphenyl)acetamide
CID 110881180
N-(3-aminophenyl)-2-(dibutylamino)acetamide
CID 28982406
3-oxo-N-(3-phenoxyphenyl)dodecanamide
CID 71475050
N'-butyl-N-(3-methoxyphenyl)-N'-methylpropanediamide
CID 108952045
2-[2-hydroxypropyl(propan-2-yl)amino]-N-(3-phenoxyphenyl)acetamide
CID 86897268
4-chloro-N-(3-phenoxyphenyl)butanamide
CID 63308949
2-[[amino-(3-phenoxyanilino)methylidene]amino]-N-phenylacetamide
CID 111599308
2-[3-[2-oxo-2-(3-phenoxyanilino)ethoxy]phenyl]acetamide
CID 48934810
2-methyl-N-(3-phenoxyphenyl)butanamide
CID 53364670
2-ethyl-1-(3-phenoxyphenyl)guanidine
CID 55068736
2-[(2-amino-2-oxoethyl)-[2-(3-fluoroanilino)-2-oxoethyl]amino]acetic acid
CID 107440293
2-[2,2-dimethylpropyl(3-hydroxypropyl)amino]-N-(3-methoxyphenyl)acetamide
CID 111107285

Frequently Asked Questions

What is the IUPAC name of 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide?
The IUPAC name of 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide (CID 60508723) is 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide.
What is the SMILES notation for 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide?
The canonical SMILES for 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide is CCCCN(CC(N)=O)CC(=O)Nc1cccc(Oc2ccccc2)c1.
What is the InChIKey of 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide?
The InChIKey is FLPVCVUVANZPLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-2-3-12-23(14-19(21)24)15-20(25)22-16-8-7-11-18(13-16)26-17-9-5-4-6-10-17/h4-11,13H,2-3,12,14-15H2,1H3,(H2,21,24)(H,22,25).
What are the key properties of 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide?
2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide has a molecular weight of 355.44 g/mol, XLogP of 3.00, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-[2-oxo-2-(3-phenoxyanilino)ethyl]amino]acetamide is sourced from PubChem (CID 60508723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).