4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide

C20H21F2N3O3 — CID 118913406

IUPAC4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
SMILESO=C(Nc1cc(F)ccc1C(=O)NCCN1CCOCC1)c1ccccc1F
InChIInChI=1S/C20H21F2N3O3/c21-14-5-6-16(19(26)23-7-8-25-9-11-28-12-10-25)18(13-14)24-20(27)15-3-1-2-4-17(15)22/h1-6,13H,7-12H2,(H,23,26)(H,24,27)
InChIKeyPCVCFUBEKCGUQL-UHFFFAOYSA-N
MW389.40 g/mol
LogP2.28
Rot. Bonds6

About 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide

4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 118913406) has the molecular formula C20H21F2N3O3 and a molecular weight of 389.40 g/mol. Its IUPAC name is 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID118913406
Molecular FormulaC20H21F2N3O3
Molecular Weight389.40 g/mol
Exact Mass389.16
IUPAC Name4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
SMILESO=C(Nc1cc(F)ccc1C(=O)NCCN1CCOCC1)c1ccccc1F
InChIInChI=1S/C20H21F2N3O3/c21-14-5-6-16(19(26)23-7-8-25-9-11-28-12-10-25)18(13-14)24-20(27)15-3-1-2-4-17(15)22/h1-6,13H,7-12H2,(H,23,26)(H,24,27)
InChIKeyPCVCFUBEKCGUQL-UHFFFAOYSA-N
XLogP2.28
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.40
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-N-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]benzamide
CID 46993248
2-amino-4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
CID 55138823
2-methyl-N-[2-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 27241616
4-N-(2,4-difluorophenyl)-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045931
2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
5-amino-2-fluoro-N-(2-morpholin-4-ylethyl)benzamide
CID 43510748
4-[(2,6-difluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)-1H-pyrazole-5-carboxamide
CID 59733429
2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 42751375
2,4-dichloro-N-[4-chloro-2-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 991469
2-fluoro-N-[2-[4-(2-fluorobenzoyl)piperazin-1-yl]ethyl]benzamide
CID 3455522
N-[2-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 50950015
4-fluoro-2-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 115745095

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide (CID 118913406) is 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide is O=C(Nc1cc(F)ccc1C(=O)NCCN1CCOCC1)c1ccccc1F.
What is the InChIKey of 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is PCVCFUBEKCGUQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21F2N3O3/c21-14-5-6-16(19(26)23-7-8-25-9-11-28-12-10-25)18(13-14)24-20(27)15-3-1-2-4-17(15)22/h1-6,13H,7-12H2,(H,23,26)(H,24,27).
What are the key properties of 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide?
4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 389.40 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-[(2-fluorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 118913406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).