12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene

C12H20N2 — CID 572172

IUPAC12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene
SMILESCC1(C)C2N=NC1C1CCCCCC12
InChIInChI=1S/C12H20N2/c1-12(2)10-8-6-4-3-5-7-9(8)11(12)14-13-10/h8-11H,3-7H2,1-2H3
InChIKeyPPPLDPFSNCLDQV-UHFFFAOYSA-N
MW192.31 g/mol
LogP3.43
Rot. Bonds

About 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene

12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene (PubChem CID 572172) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene.

Molecular Properties

Compound Name12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene
PubChem CID572172
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene
SMILESCC1(C)C2N=NC1C1CCCCCC12
InChIInChI=1S/C12H20N2/c1-12(2)10-8-6-4-3-5-7-9(8)11(12)14-13-10/h8-11H,3-7H2,1-2H3
InChIKeyPPPLDPFSNCLDQV-UHFFFAOYSA-N
XLogP3.43
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(9aR)-9-cyclohexyl-10,10-dimethyl-2,3,4,4a,5,6,7,8,8a,9,9a,10a-dodecahydro-1H-anthracene
CID 140752694
tricyclo[5.4.0.08,11]undecane
CID 176586412
tricyclo[5.5.0.02,6]dodecane
CID 578151
7,7-dimethyl-1,2,3,3a,3b,4,5,6,6a,7a-decahydrocyclopenta[a]pentalene
CID 85195042
11,11-dimethylbicyclo[4.4.1]undecane
CID 71443320
(1R,8R)-9-methylbicyclo[6.1.0]nonane
CID 12870202
cyclohexyl(dimethyl)silane
CID 4205682
N-ethyl-9,9-dimethylbicyclo[5.2.0]nonan-8-amine
CID 81422931
(1S,2S,6R,7R)-tricyclo[5.4.0.02,6]undecane
CID 101375325
14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine
CID 81422701
5-cyclohexyl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 59124996
1-cyclohexyl-3,3-dimethyldiaziridine
CID 71679608

Frequently Asked Questions

What is the IUPAC name of 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene?
The IUPAC name of 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene (CID 572172) is 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene.
What is the SMILES notation for 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene?
The canonical SMILES for 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene is CC1(C)C2N=NC1C1CCCCCC12.
What is the InChIKey of 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene?
The InChIKey is PPPLDPFSNCLDQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-12(2)10-8-6-4-3-5-7-9(8)11(12)14-13-10/h8-11H,3-7H2,1-2H3.
What are the key properties of 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene?
12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene has a molecular weight of 192.31 g/mol, XLogP of 3.43, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12,12-dimethyl-10,11-diazatricyclo[7.2.1.02,8]dodec-10-ene is sourced from PubChem (CID 572172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).