N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide

C20H22N2O3 — CID 24581450

IUPACN-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide
SMILESCc1ccc(C)c(OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C20H22N2O3/c1-13-6-7-14(2)18(10-13)25-12-19(23)21-17-5-3-4-15(11-17)20(24)22-16-8-9-16/h3-7,10-11,16H,8-9,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyUYTZYIVZVYVSRN-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.21
Rot. Bonds6

About N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide

N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide (PubChem CID 24581450) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide
PubChem CID24581450
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide
SMILESCc1ccc(C)c(OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C20H22N2O3/c1-13-6-7-14(2)18(10-13)25-12-19(23)21-17-5-3-4-15(11-17)20(24)22-16-8-9-16/h3-7,10-11,16H,8-9,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyUYTZYIVZVYVSRN-UHFFFAOYSA-N
XLogP3.21
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 26164583
3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 17218964
N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide
CID 4113350
N-cyclohexyl-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzamide
CID 17170486
N-(3-bromophenyl)-2-(2,5-dimethylphenoxy)acetamide
CID 17252160
[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] 2,4,6-trimethylbenzoate
CID 42039111
propyl 3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzoate
CID 19167371
N-[3-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 17188255
methyl 3-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethoxy]benzoate
CID 42157013
N-cyclopropyl-3-[[2-(3-ethylphenoxy)acetyl]amino]benzamide
CID 26993706
3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-N,N-dipropylbenzamide
CID 26162321
3-[[2-(2-methylphenoxy)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 26164549

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide (CID 24581450) is N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide is Cc1ccc(C)c(OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1.
What is the InChIKey of N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide?
The InChIKey is UYTZYIVZVYVSRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-13-6-7-14(2)18(10-13)25-12-19(23)21-17-5-3-4-15(11-17)20(24)22-16-8-9-16/h3-7,10-11,16H,8-9,12H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide?
N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide has a molecular weight of 338.41 g/mol, XLogP of 3.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide is sourced from PubChem (CID 24581450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).