3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane

C64H126N10 — CID 158091829

IUPAC3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane
SMILESCC(C)N1C2CCC1CN(C)C2.CC(C)N1C2CCC1CN(C)CC2.CC(C)N1CC2CCC(C1)N2C.CC(C)N1CCC2CCC(C1)N2C.CC(C)N1CCC2CCC1CC2.CC1CC2CCC(C1)N2C(C)C
InChIInChI=1S/2C11H22N2.2C11H21N.2C10H20N2/c1-9(2)13-7-6-10-4-5-11(8-13)12(10)3;1-9(2)13-10-4-5-11(13)8-12(3)7-6-10;1-8(2)12-10-4-5-11(12)7-9(3)6-10;1-9(2)12-8-7-10-3-5-11(12)6-4-10;1-8(2)12-6-9-4-5-10(7-12)11(9)3;1-8(2)12-9-4-5-10(12)7-11(3)6-9/h2*9-11H,4-8H2,1-3H3;8-11H,4-7H2,1-3H3;9-11H,3-8H2,1-2H3;2*8-10H,4-7H2,1-3H3
InChIKeyFOESLFFQVLZBCD-UHFFFAOYSA-N
MW1035.78 g/mol
LogP10.79
Rot. Bonds6

About 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane

3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane (PubChem CID 158091829) has the molecular formula C64H126N10 and a molecular weight of 1035.78 g/mol. Its IUPAC name is 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane.

Molecular Properties

Compound Name3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane
PubChem CID158091829
Molecular FormulaC64H126N10
Molecular Weight1035.78 g/mol
Exact Mass1035.02
IUPAC Name3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane
SMILESCC(C)N1C2CCC1CN(C)C2.CC(C)N1C2CCC1CN(C)CC2.CC(C)N1CC2CCC(C1)N2C.CC(C)N1CCC2CCC(C1)N2C.CC(C)N1CCC2CCC1CC2.CC1CC2CCC(C1)N2C(C)C
InChIInChI=1S/2C11H22N2.2C11H21N.2C10H20N2/c1-9(2)13-7-6-10-4-5-11(8-13)12(10)3;1-9(2)13-10-4-5-11(13)8-12(3)7-6-10;1-8(2)12-10-4-5-11(12)7-9(3)6-10;1-9(2)12-8-7-10-3-5-11(12)6-4-10;1-8(2)12-6-9-4-5-10(7-12)11(9)3;1-8(2)12-9-4-5-10(12)7-11(3)6-9/h2*9-11H,4-8H2,1-3H3;8-11H,4-7H2,1-3H3;9-11H,3-8H2,1-2H3;2*8-10H,4-7H2,1-3H3
InChIKeyFOESLFFQVLZBCD-UHFFFAOYSA-N
XLogP10.79
TPSA32.40 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms74
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001035.78
LogP ≤ 510.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane with MolForge

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Related Compounds

2-Methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane;2-propan-2-yl-2-azabicyclo[3.2.1]octane
CID 157252335
Methane;2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane;2-propan-2-yl-2-azabicyclo[3.2.1]octane
CID 157316811
Methane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;bis(3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane);8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonane
CID 157346315
Methane;2-methyl-2-azabicyclo[2.2.1]heptane;2-methylpropane;3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;bis(2-propan-2-yl-2-azabicyclo[2.2.1]heptane);2-propan-2-yl-2-azabicyclo[3.2.2]nonane;2-propan-2-yl-2-azabicyclo[3.2.1]octane
CID 157352114
3-Methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;bis(2-propan-2-yl-2-azabicyclo[2.2.1]heptane);2-propan-2-yl-2-azabicyclo[3.2.2]nonane;2-propan-2-yl-2-azabicyclo[3.2.1]octane;5-propan-2-yl-2,5-diazatricyclo[6.2.1.02,7]undecane
CID 157507102
1,4-Di(propan-2-yl)-4-aza-1-azoniabicyclo[3.2.2]nonane;1,4-di(propan-2-yl)-1-azoniabicyclo[2.2.1]heptane;1,5-di(propan-2-yl)-1-azoniabicyclo[3.3.1]nonane;1,4-di(propan-2-yl)-1-azoniabicyclo[2.2.2]octane;1,1-di(propan-2-yl)pyrrolidin-1-ium;5-methyl-2,5-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-ium;8-methyl-3,8-di(propan-2-yl)-8-azoniabicyclo[3.2.1]octane
CID 158581663
dimethyl-di(propan-2-yl)azanium;1,4-di(propan-2-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium;4,8-di(propan-2-yl)-1,2,3,5,6,7-hexahydropyrrolizin-4-ium;9-methyl-3,9-di(propan-2-yl)-3-aza-9-azoniabicyclo[3.3.1]nonane;2-methyl-2,5-di(propan-2-yl)-5-aza-2-azoniabicyclo[2.2.2]octane;8-methyl-3,8-di(propan-2-yl)-3-aza-8-azoniabicyclo[3.2.1]octane;9-methyl-3,9-di(propan-2-yl)-9-azoniabicyclo[3.3.1]nonane;8-methyl-3,8-di(propan-2-yl)-8-azoniabicyclo[3.2.1]octane
CID 159397637
3-Methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;bis(3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane);8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane
CID 159632645
2-Methyl-2-azabicyclo[2.2.1]heptane;2-methylpropane;3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;bis(2-propan-2-yl-2-azabicyclo[2.2.1]heptane);2-propan-2-yl-2-azabicyclo[3.2.2]nonane;2-propan-2-yl-2-azabicyclo[3.2.1]octane
CID 160297892

Frequently Asked Questions

What is the IUPAC name of 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane?
The IUPAC name of 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane (CID 158091829) is 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane.
What is the SMILES notation for 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane?
The canonical SMILES for 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane is CC(C)N1C2CCC1CN(C)C2.CC(C)N1C2CCC1CN(C)CC2.CC(C)N1CC2CCC(C1)N2C.CC(C)N1CCC2CCC(C1)N2C.CC(C)N1CCC2CCC1CC2.CC1CC2CCC(C1)N2C(C)C.
What is the InChIKey of 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane?
The InChIKey is FOESLFFQVLZBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H22N2.2C11H21N.2C10H20N2/c1-9(2)13-7-6-10-4-5-11(8-13)12(10)3;1-9(2)13-10-4-5-11(13)8-12(3)7-6-10;1-8(2)12-10-4-5-11(12)7-9(3)6-10;1-9(2)12-8-7-10-3-5-11(12)6-4-10;1-8(2)12-6-9-4-5-10(7-12)11(9)3;1-8(2)12-9-4-5-10(12)7-11(3)6-9/h2*9-11H,4-8H2,1-3H3;8-11H,4-7H2,1-3H3;9-11H,3-8H2,1-2H3;2*8-10H,4-7H2,1-3H3.
What are the key properties of 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane?
3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane has a molecular weight of 1035.78 g/mol, XLogP of 10.79, 6 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-8-propan-2-yl-8-azabicyclo[3.2.1]octane;3-methyl-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;9-methyl-3-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane;3-methyl-8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-methyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-propan-2-yl-2-azabicyclo[3.2.2]nonane is sourced from PubChem (CID 158091829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).