N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide

C19H18FN3O3 — CID 154810861

IUPACN-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide
SMILESO=C1CCC(NC(=O)c2c3c(nc4ccc(F)cc24)CCCC3)C(=O)N1
InChIInChI=1S/C19H18FN3O3/c20-10-5-6-14-12(9-10)17(11-3-1-2-4-13(11)21-14)19(26)22-15-7-8-16(24)23-18(15)25/h5-6,9,15H,1-4,7-8H2,(H,22,26)(H,23,24,25)
InChIKeyMMNPCOXVHZRPFD-UHFFFAOYSA-N
MW355.37 g/mol
LogP1.79
Rot. Bonds2

About N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide

N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide (PubChem CID 154810861) has the molecular formula C19H18FN3O3 and a molecular weight of 355.37 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide
PubChem CID154810861
Molecular FormulaC19H18FN3O3
Molecular Weight355.37 g/mol
Exact Mass355.13
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide
SMILESO=C1CCC(NC(=O)c2c3c(nc4ccc(F)cc24)CCCC3)C(=O)N1
InChIInChI=1S/C19H18FN3O3/c20-10-5-6-14-12(9-10)17(11-3-1-2-4-13(11)21-14)19(26)22-15-7-8-16(24)23-18(15)25/h5-6,9,15H,1-4,7-8H2,(H,22,26)(H,23,24,25)
InChIKeyMMNPCOXVHZRPFD-UHFFFAOYSA-N
XLogP1.79
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.37
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid
CID 865221
N-(2,6-dioxopiperidin-3-yl)-4-fluoro-2-formylbenzamide
CID 134581835
N-(2,6-dioxopiperidin-3-yl)-5-fluoropyridine-3-carboxamide
CID 115747901
N-butan-2-yl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 53016227
N-(2,6-dioxopiperidin-3-yl)benzamide;ethane
CID 156866709
N-(2,6-dioxopiperidin-3-yl)-3-phenylbenzamide
CID 138467355
N-(2,4-difluorophenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 9247827
N-cycloheptyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxamide
CID 2451567
(4-fluorophenyl) N-(2,6-dioxopiperidin-3-yl)carbamate
CID 167480210
4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide
CID 2363882
2-(7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)acetic acid
CID 82451440
2-chloro-N-(2,6-dioxopiperidin-3-yl)furan-3-carboxamide
CID 106686964

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide (CID 154810861) is N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide is O=C1CCC(NC(=O)c2c3c(nc4ccc(F)cc24)CCCC3)C(=O)N1.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide?
The InChIKey is MMNPCOXVHZRPFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O3/c20-10-5-6-14-12(9-10)17(11-3-1-2-4-13(11)21-14)19(26)22-15-7-8-16(24)23-18(15)25/h5-6,9,15H,1-4,7-8H2,(H,22,26)(H,23,24,25).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide?
N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide has a molecular weight of 355.37 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-7-fluoro-1,2,3,4-tetrahydroacridine-9-carboxamide is sourced from PubChem (CID 154810861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).