N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide

C18H16Cl2N2O3 — CID 7729391

IUPACN-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C18H16Cl2N2O3/c19-11-5-8-16(14(20)9-11)25-10-17(23)22-15-4-2-1-3-13(15)18(24)21-12-6-7-12/h1-5,8-9,12H,6-7,10H2,(H,21,24)(H,22,23)
InChIKeyQZLXKSMULYHTBA-UHFFFAOYSA-N
MW379.24 g/mol
LogP3.90
Rot. Bonds6

About N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide

N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide (PubChem CID 7729391) has the molecular formula C18H16Cl2N2O3 and a molecular weight of 379.24 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide
PubChem CID7729391
Molecular FormulaC18H16Cl2N2O3
Molecular Weight379.24 g/mol
Exact Mass378.05
IUPAC NameN-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C18H16Cl2N2O3/c19-11-5-8-16(14(20)9-11)25-10-17(23)22-15-4-2-1-3-13(15)18(24)21-12-6-7-12/h1-5,8-9,12H,6-7,10H2,(H,21,24)(H,22,23)
InChIKeyQZLXKSMULYHTBA-UHFFFAOYSA-N
XLogP3.90
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.24
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] 4-chloro-2-fluorobenzoate
CID 8664244
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
CID 2198238
2-[[2-(2-bromo-4,6-dichlorophenoxy)acetyl]amino]-N-cyclohexylbenzamide
CID 17095359
N-(2-benzoyl-4-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 3544695
N-cyclohexyl-2-[3-(2,4-dichlorophenyl)propanoylamino]benzamide
CID 100606317
N-[1-[2-(2,4-dichlorophenoxy)acetyl]piperidin-4-yl]-2-hydroxybenzamide
CID 108551390
2-(2,4-dichlorophenoxy)-N-piperidin-4-ylacetamide;hydrochloride
CID 119385688
2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]acetic acid
CID 166178801
2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide
CID 17186619
[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] 2-(2,4-dimethylphenoxy)acetate
CID 7815364
2-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethoxy]acetic acid
CID 60662463

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide (CID 7729391) is N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide is O=C(COc1ccc(Cl)cc1Cl)Nc1ccccc1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide?
The InChIKey is QZLXKSMULYHTBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N2O3/c19-11-5-8-16(14(20)9-11)25-10-17(23)22-15-4-2-1-3-13(15)18(24)21-12-6-7-12/h1-5,8-9,12H,6-7,10H2,(H,21,24)(H,22,23).
What are the key properties of N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide?
N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide has a molecular weight of 379.24 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide is sourced from PubChem (CID 7729391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).