5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane

C13H22N2 — CID 141201205

IUPAC5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane
SMILESCC1C(C2CC2)NNC2C3CCC(C3)C12
InChIInChI=1S/C13H22N2/c1-7-11-9-4-5-10(6-9)13(11)15-14-12(7)8-2-3-8/h7-15H,2-6H2,1H3
InChIKeyLSGYCFLUHLWMDE-UHFFFAOYSA-N
MW206.33 g/mol
LogP1.92
Rot. Bonds1

About 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane

5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane (PubChem CID 141201205) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane.

Molecular Properties

Compound Name5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane
PubChem CID141201205
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane
SMILESCC1C(C2CC2)NNC2C3CCC(C3)C12
InChIInChI=1S/C13H22N2/c1-7-11-9-4-5-10(6-9)13(11)15-14-12(7)8-2-3-8/h7-15H,2-6H2,1H3
InChIKeyLSGYCFLUHLWMDE-UHFFFAOYSA-N
XLogP1.92
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,3R,4S)-2,3-dimethylbicyclo[2.2.1]heptane
CID 163414856
(1R,3S,4S)-2,3-dimethylbicyclo[2.2.1]heptane
CID 91107187
(1S,4R)-5-methylbicyclo[2.1.1]hexane
CID 154518789
(1S,4S,7S,10S)-pentacyclo[8.2.1.14,7.02,9.03,8]tetradecane
CID 124764509
nonadecacyclo[27.23.1.14,44.06,43.09,42.011,40.014,39.016,37.019,36.021,34.024,33.026,31.030,51.032,49.035,48.038,47.041,46.045,50.052,54]tetrapentacontane
CID 101083105
3,4-dimethyltricyclo[5.2.1.02,6]decane;ethane
CID 90804834
3,7,8,9-tetramethyl-5-azatricyclo[4.1.1.12,4]nonane
CID 89258092
(3R,5R,8S,12R,17S,19S,22S,23S,24R,29S,32R)-dodecacyclo[15.13.1.13,26.05,25.08,24.010,22.012,21.014,19.018,29.020,28.023,27.030,32]dotriacontane
CID 58820692
7-methyltricyclo[4.3.1.03,10]decane
CID 147439470
2,3-dimethylbicyclo[2.2.1]heptane;methoxymethane
CID 123361313
N,3-dimethylbicyclo[2.2.1]heptan-2-amine;hydrochloride
CID 138397495
2-(2-bicyclo[2.2.1]heptanyl)-3-methylbicyclo[2.2.1]heptane
CID 132601108

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane?
The IUPAC name of 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane (CID 141201205) is 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane.
What is the SMILES notation for 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane?
The canonical SMILES for 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane is CC1C(C2CC2)NNC2C3CCC(C3)C12.
What is the InChIKey of 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane?
The InChIKey is LSGYCFLUHLWMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-7-11-9-4-5-10(6-9)13(11)15-14-12(7)8-2-3-8/h7-15H,2-6H2,1H3.
What are the key properties of 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane?
5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane has a molecular weight of 206.33 g/mol, XLogP of 1.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-6-methyl-3,4-diazatricyclo[6.2.1.02,7]undecane is sourced from PubChem (CID 141201205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).