2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide

C19H16ClFN2O3 — CID 2981754

IUPAC2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide
SMILESO=C(c1ccccc1Cl)N(Cc1ccccc1F)N1C(=O)CCCC1=O
InChIInChI=1S/C19H16ClFN2O3/c20-15-8-3-2-7-14(15)19(26)22(12-13-6-1-4-9-16(13)21)23-17(24)10-5-11-18(23)25/h1-4,6-9H,5,10-12H2
InChIKeyLIPGYPGWYQLFSF-UHFFFAOYSA-N
MW374.80 g/mol
LogP3.58
Rot. Bonds4

About 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide

2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide (PubChem CID 2981754) has the molecular formula C19H16ClFN2O3 and a molecular weight of 374.80 g/mol. Its IUPAC name is 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide
PubChem CID2981754
Molecular FormulaC19H16ClFN2O3
Molecular Weight374.80 g/mol
Exact Mass374.08
IUPAC Name2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide
SMILESO=C(c1ccccc1Cl)N(Cc1ccccc1F)N1C(=O)CCCC1=O
InChIInChI=1S/C19H16ClFN2O3/c20-15-8-3-2-7-14(15)19(26)22(12-13-6-1-4-9-16(13)21)23-17(24)10-5-11-18(23)25/h1-4,6-9H,5,10-12H2
InChIKeyLIPGYPGWYQLFSF-UHFFFAOYSA-N
XLogP3.58
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.80
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

1-Benzyl-4-(3-chlorobenzoyl)piperazine
CID 720140
Ochlorodibenzoyl1tbutylhydrazine4fluoro
CID 23276455
1-(3-Chlorobenzoyl)-4-(2-fluorobenzoyl)piperazine
CID 660542
4-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide
CID 2233946
N-tert-butyl-2-chloro-N'-(3-fluorobenzoyl)benzohydrazide
CID 23276456
N-tert-butyl-2-chloro-N'-(2-fluorobenzoyl)benzohydrazide
CID 23276458
(4-Benzylpiperidin-1-yl)(2-chlorophenyl)methanone
CID 667590
[4-(4-Chloro-benzoyl)-piperidin-1-yl]-(4-fluoro-phenyl)-methanone
CID 1437838
1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine
CID 717254
1-(2-Chloro-4,5-difluorobenzoyl)piperidine
CID 744426
1-(2-Chloro-4,5-difluorobenzoyl)-4-(2-phenylethyl)piperazine
CID 1244283
(4-Chloro-phenyl)-[4-(4-fluoro-benzoyl)-piperidin-1-yl]-methanone
CID 1437841

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide?
The IUPAC name of 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide (CID 2981754) is 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide.
What is the SMILES notation for 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide?
The canonical SMILES for 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide is O=C(c1ccccc1Cl)N(Cc1ccccc1F)N1C(=O)CCCC1=O.
What is the InChIKey of 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide?
The InChIKey is LIPGYPGWYQLFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClFN2O3/c20-15-8-3-2-7-14(15)19(26)22(12-13-6-1-4-9-16(13)21)23-17(24)10-5-11-18(23)25/h1-4,6-9H,5,10-12H2.
What are the key properties of 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide?
2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide has a molecular weight of 374.80 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,6-dioxopiperidin-1-yl)-N-[(2-fluorophenyl)methyl]benzamide is sourced from PubChem (CID 2981754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).