2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide

C20H22FN3O3 — CID 113000301

IUPAC2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide
SMILESO=C(Cc1ccccc1F)NCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C20H22FN3O3/c21-16-6-2-1-5-15(16)13-19(25)22-14-20(26)23-17-7-3-4-8-18(17)24-9-11-27-12-10-24/h1-8H,9-14H2,(H,22,25)(H,23,26)
InChIKeyBXNUVCGGMAMJJE-UHFFFAOYSA-N
MW371.41 g/mol
LogP1.96
Rot. Bonds6

About 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide

2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide (PubChem CID 113000301) has the molecular formula C20H22FN3O3 and a molecular weight of 371.41 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide
PubChem CID113000301
Molecular FormulaC20H22FN3O3
Molecular Weight371.41 g/mol
Exact Mass371.16
IUPAC Name2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide
SMILESO=C(Cc1ccccc1F)NCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C20H22FN3O3/c21-16-6-2-1-5-15(16)13-19(25)22-14-20(26)23-17-7-3-4-8-18(17)24-9-11-27-12-10-24/h1-8H,9-14H2,(H,22,25)(H,23,26)
InChIKeyBXNUVCGGMAMJJE-UHFFFAOYSA-N
XLogP1.96
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.41
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-fluorophenyl)ethyl]-N'-(2-morpholin-4-ylphenyl)propanediamide
CID 108948326
2-(2-fluorophenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 7492204
2-[(2-methylphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 108996603
2-(2-aminophenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 28712686
N-[2-[[2-(2-morpholin-4-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]thiophene-2-carboxamide
CID 17438743
N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide
CID 113000312
1-[(2-methylphenyl)methyl]-3-(2-morpholin-4-ylphenyl)urea
CID 108897210
2-bromo-N-(2-morpholin-4-ylphenyl)acetamide
CID 60650852
2-(2-methoxyphenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 2677631
[2-(2-morpholin-4-ylanilino)-2-oxoethyl] 2-fluorobenzoate
CID 4626672
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109007545

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide (CID 113000301) is 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide is O=C(Cc1ccccc1F)NCC(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide?
The InChIKey is BXNUVCGGMAMJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O3/c21-16-6-2-1-5-15(16)13-19(25)22-14-20(26)23-17-7-3-4-8-18(17)24-9-11-27-12-10-24/h1-8H,9-14H2,(H,22,25)(H,23,26).
What are the key properties of 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide?
2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide has a molecular weight of 371.41 g/mol, XLogP of 1.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide is sourced from PubChem (CID 113000301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).