N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide

C14H18N2O3 — CID 103822664

IUPACN-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide
SMILESO=C1CCC(NC(=O)C2C3C4CCC(C4)C23)C(=O)N1
InChIInChI=1S/C14H18N2O3/c17-9-4-3-8(13(18)16-9)15-14(19)12-10-6-1-2-7(5-6)11(10)12/h6-8,10-12H,1-5H2,(H,15,19)(H,16,17,18)
InChIKeyXBOPCTONZSTUHM-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.20
Rot. Bonds2

About N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide

N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide (PubChem CID 103822664) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide
PubChem CID103822664
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide
SMILESO=C1CCC(NC(=O)C2C3C4CCC(C4)C23)C(=O)N1
InChIInChI=1S/C14H18N2O3/c17-9-4-3-8(13(18)16-9)15-14(19)12-10-6-1-2-7(5-6)11(10)12/h6-8,10-12H,1-5H2,(H,15,19)(H,16,17,18)
InChIKeyXBOPCTONZSTUHM-UHFFFAOYSA-N
XLogP0.20
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-N-(2,6-dioxopiperidin-3-yl)pyrrolidine-2-carboxamide
CID 104901222
N-(2,6-dioxopiperidin-3-yl)-3,3-difluorocyclopentane-1-carboxamide
CID 114094437
N-[(3S)-2,6-dioxopiperidin-3-yl]pyrimidine-2-carboxamide
CID 156797860
N-(2,6-dioxopiperidin-3-yl)-2-sulfanylpropanamide
CID 107031614
N-(2,6-dioxopiperidin-3-yl)but-3-enamide
CID 65439330
N-cyclopentyltricyclo[3.2.1.02,4]octane-3-carboxamide
CID 103759905
ethane;S-ethyl N-(2,6-dioxopiperidin-3-yl)carbamothioate
CID 166478743
(1R)-N-(2,6-dioxopiperidin-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 142535910
5-chloro-N-(2,6-dioxopiperidin-3-yl)-1,3,4-thiadiazole-2-carboxamide
CID 80618531
(2S,3R)-2-[(2,6-dioxopiperidin-3-yl)carbamoylamino]-3-hydroxybutanoic acid
CID 104966371
(2E)-N-(2,6-dioxopiperidin-3-yl)-2-ethylidenepent-3-enamide;ethane;tungsten
CID 156866667
4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide
CID 2363882

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide (CID 103822664) is N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide is O=C1CCC(NC(=O)C2C3C4CCC(C4)C23)C(=O)N1.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide?
The InChIKey is XBOPCTONZSTUHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c17-9-4-3-8(13(18)16-9)15-14(19)12-10-6-1-2-7(5-6)11(10)12/h6-8,10-12H,1-5H2,(H,15,19)(H,16,17,18).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide?
N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)tricyclo[3.2.1.02,4]octane-3-carboxamide is sourced from PubChem (CID 103822664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).