2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide

C19H19Cl2N3O3 — CID 54810917

IUPAC2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
SMILESO=C(CNc1ccc(Cl)cc1Cl)Nc1cccc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C19H19Cl2N3O3/c20-14-4-5-17(16(21)11-14)22-12-18(25)23-15-3-1-2-13(10-15)19(26)24-6-8-27-9-7-24/h1-5,10-11,22H,6-9,12H2,(H,23,25)
InChIKeyFRBDRLDPSUGOEO-UHFFFAOYSA-N
MW408.29 g/mol
LogP3.52
Rot. Bonds5

About 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide

2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide (PubChem CID 54810917) has the molecular formula C19H19Cl2N3O3 and a molecular weight of 408.29 g/mol. Its IUPAC name is 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
PubChem CID54810917
Molecular FormulaC19H19Cl2N3O3
Molecular Weight408.29 g/mol
Exact Mass407.08
IUPAC Name2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
SMILESO=C(CNc1ccc(Cl)cc1Cl)Nc1cccc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C19H19Cl2N3O3/c20-14-4-5-17(16(21)11-14)22-12-18(25)23-15-3-1-2-13(10-15)19(26)24-6-8-27-9-7-24/h1-5,10-11,22H,6-9,12H2,(H,23,25)
InChIKeyFRBDRLDPSUGOEO-UHFFFAOYSA-N
XLogP3.52
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.29
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dichloroanilino)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54819586
2-[3-(morpholine-4-carbonyl)anilino]-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54836347
2-(2-chloroanilino)-N-[3-(piperidine-1-carbonyl)phenyl]acetamide
CID 54810249
2-(3-acetamidoanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
CID 54831502
2-[4-(morpholine-4-carbonyl)anilino]-N-[3-(piperidine-1-carbonyl)phenyl]acetamide
CID 54832001
2-(2-chloroanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
CID 54810418
N-[3-(morpholine-4-carbonyl)phenyl]-2-(2-propan-2-yloxyanilino)acetamide
CID 54830960
N-(3-acetylphenyl)-2-(5-chloro-2-morpholin-4-ylanilino)acetamide
CID 9104932
2-bromo-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
CID 46736679
N-tert-butyl-3-[[2-[3-(morpholine-4-carbonyl)anilino]-2-oxoethyl]amino]benzamide
CID 54844342
N-[4-[[2-[3-(morpholine-4-carbonyl)anilino]-2-oxoethyl]amino]phenyl]butanamide
CID 54836996
N-[4-(morpholine-4-carbonyl)phenyl]-2-[3-(piperidine-1-carbonyl)anilino]acetamide
CID 54843375

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide (CID 54810917) is 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide is O=C(CNc1ccc(Cl)cc1Cl)Nc1cccc(C(=O)N2CCOCC2)c1.
What is the InChIKey of 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is FRBDRLDPSUGOEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2N3O3/c20-14-4-5-17(16(21)11-14)22-12-18(25)23-15-3-1-2-13(10-15)19(26)24-6-8-27-9-7-24/h1-5,10-11,22H,6-9,12H2,(H,23,25).
What are the key properties of 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide?
2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 408.29 g/mol, XLogP of 3.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloroanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 54810917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).