2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide

C18H18ClF2N3O2 — CID 7922878

IUPAC2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide
SMILESO=C(CNc1cc(Cl)ccc1N1CCOCC1)Nc1ccc(F)c(F)c1
InChIInChI=1S/C18H18ClF2N3O2/c19-12-1-4-17(24-5-7-26-8-6-24)16(9-12)22-11-18(25)23-13-2-3-14(20)15(21)10-13/h1-4,9-10,22H,5-8,11H2,(H,23,25)
InChIKeyUEFUDOVASUYYPK-UHFFFAOYSA-N
MW381.81 g/mol
LogP3.51
Rot. Bonds5

About 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide

2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide (PubChem CID 7922878) has the molecular formula C18H18ClF2N3O2 and a molecular weight of 381.81 g/mol. Its IUPAC name is 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide
PubChem CID7922878
Molecular FormulaC18H18ClF2N3O2
Molecular Weight381.81 g/mol
Exact Mass381.11
IUPAC Name2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide
SMILESO=C(CNc1cc(Cl)ccc1N1CCOCC1)Nc1ccc(F)c(F)c1
InChIInChI=1S/C18H18ClF2N3O2/c19-12-1-4-17(24-5-7-26-8-6-24)16(9-12)22-11-18(25)23-13-2-3-14(20)15(21)10-13/h1-4,9-10,22H,5-8,11H2,(H,23,25)
InChIKeyUEFUDOVASUYYPK-UHFFFAOYSA-N
XLogP3.51
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.81
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-2-(5-chloro-2-morpholin-4-ylanilino)acetamide
CID 9104932
N-(4-bromo-2-methylphenyl)-2-(5-chloro-2-morpholin-4-ylanilino)acetamide
CID 26439639
N-(3-fluoro-4-methylphenyl)-2-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylanilino)acetamide
CID 29327873
2-(5-chloro-2-methylanilino)-N-(3,4-difluorophenyl)acetamide
CID 9102939
N-(5-chloro-2-methylphenyl)-2-(2-morpholin-4-ylanilino)acetamide
CID 109008560
2-(5-chloro-2-morpholin-4-ylanilino)-N-[1-(4-chlorophenyl)ethyl]acetamide
CID 55365315
2-[2-(5-chloro-2-morpholin-4-ylanilino)-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide
CID 24981722
N-(3-fluoro-4-morpholin-4-ylphenyl)propanamide
CID 144950070
2-(5-chloro-2-morpholin-4-ylanilino)-N-(thiophen-2-ylmethyl)acetamide
CID 51199571
2-(5-chloro-2-methoxyanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 99144350
2-(4-chloroanilino)-N-(3,4-difluorophenyl)acetamide
CID 9098972
(3Z)-3-amino-N-(5-chloro-2-morpholin-4-ylphenyl)-3-hydroxyiminopropanamide
CID 16777669

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide?
The IUPAC name of 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide (CID 7922878) is 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide?
The canonical SMILES for 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide is O=C(CNc1cc(Cl)ccc1N1CCOCC1)Nc1ccc(F)c(F)c1.
What is the InChIKey of 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide?
The InChIKey is UEFUDOVASUYYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClF2N3O2/c19-12-1-4-17(24-5-7-26-8-6-24)16(9-12)22-11-18(25)23-13-2-3-14(20)15(21)10-13/h1-4,9-10,22H,5-8,11H2,(H,23,25).
What are the key properties of 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide?
2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide has a molecular weight of 381.81 g/mol, XLogP of 3.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-morpholin-4-ylanilino)-N-(3,4-difluorophenyl)acetamide is sourced from PubChem (CID 7922878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).