(1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione

C10H14N2O2 — CID 130840841

IUPAC(1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione
SMILESC[C@]12C[C@@H]3CCC[C@@]3(NC1=O)C(=O)N2
InChIInChI=1S/C10H14N2O2/c1-9-5-6-3-2-4-10(6,8(14)11-9)12-7(9)13/h6H,2-5H2,1H3,(H,11,14)(H,12,13)/t6-,9-,10-/m0/s1
InChIKeyPGKCRTBZUFFRCW-JUWDTYFHSA-N
MW194.23 g/mol
LogP-0.07
Rot. Bonds

About (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione

(1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione (PubChem CID 130840841) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione.

Molecular Properties

Compound Name(1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione
PubChem CID130840841
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione
SMILESC[C@]12C[C@@H]3CCC[C@@]3(NC1=O)C(=O)N2
InChIInChI=1S/C10H14N2O2/c1-9-5-6-3-2-4-10(6,8(14)11-9)12-7(9)13/h6H,2-5H2,1H3,(H,11,14)(H,12,13)/t6-,9-,10-/m0/s1
InChIKeyPGKCRTBZUFFRCW-JUWDTYFHSA-N
XLogP-0.07
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R,5R,7R)-8-benzyl-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione
CID 11243092
1-methyl-2,5-diazaspiro[3.4]octan-3-one
CID 90330182
(5S,9S)-9-fluoro-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 46939003
6a-methyl-2,3,3a,4,5,6-hexahydropentalen-1-one
CID 13215924
8a-methyl-2,3,4,4a,5,6,7,8-octahydroisoquinolin-1-one
CID 59871614
3a-methyl-1,2,3,5,6,7,8,8a-octahydroazulen-4-one
CID 557031
5-methyl-6-azabicyclo[3.2.1]octan-7-one
CID 119053641
(5S)-5-cyclohexyl-5-methylimidazolidine-2,4-dione
CID 6927018
(1R,5S)-5-methyl-6-azabicyclo[3.2.1]octan-7-one
CID 129413421
9-(methylsulfonylmethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 20798889
(3aS,6aS)-6,6a-dimethyl-2,3,3a,4-tetrahydro-1H-pentalene
CID 101365491
methyl (3R,4aR,7aR)-3-acetamido-3-methyl-2-oxo-1,4,4a,5,6,7-hexahydrocyclopenta[b]pyridine-7a-carboxylate
CID 11425643

Frequently Asked Questions

What is the IUPAC name of (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione?
The IUPAC name of (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione (CID 130840841) is (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione.
What is the SMILES notation for (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione?
The canonical SMILES for (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione is C[C@]12C[C@@H]3CCC[C@@]3(NC1=O)C(=O)N2.
What is the InChIKey of (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione?
The InChIKey is PGKCRTBZUFFRCW-JUWDTYFHSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-9-5-6-3-2-4-10(6,8(14)11-9)12-7(9)13/h6H,2-5H2,1H3,(H,11,14)(H,12,13)/t6-,9-,10-/m0/s1.
What are the key properties of (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione?
(1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione has a molecular weight of 194.23 g/mol, XLogP of -0.07, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5S,7S)-7-methyl-8,10-diazatricyclo[5.2.2.01,5]undecane-9,11-dione is sourced from PubChem (CID 130840841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).