8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride

C10H22Cl2N2 — CID 67212524

IUPAC8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
SMILESCC(C)N1C2CCC1CC(N)C2.Cl.Cl
InChIInChI=1S/C10H20N2.2ClH/c1-7(2)12-9-3-4-10(12)6-8(11)5-9;;/h7-10H,3-6,11H2,1-2H3;2*1H
InChIKeyJIVXTYIIRDPPSZ-UHFFFAOYSA-N
MW241.21 g/mol
LogP2.19
Rot. Bonds1

About 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride

8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride (PubChem CID 67212524) has the molecular formula C10H22Cl2N2 and a molecular weight of 241.21 g/mol. Its IUPAC name is 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride.

Molecular Properties

Compound Name8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
PubChem CID67212524
Molecular FormulaC10H22Cl2N2
Molecular Weight241.21 g/mol
Exact Mass240.12
IUPAC Name8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
SMILESCC(C)N1C2CCC1CC(N)C2.Cl.Cl
InChIInChI=1S/C10H20N2.2ClH/c1-7(2)12-9-3-4-10(12)6-8(11)5-9;;/h7-10H,3-6,11H2,1-2H3;2*1H
InChIKeyJIVXTYIIRDPPSZ-UHFFFAOYSA-N
XLogP2.19
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.21
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride with MolForge

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Related Compounds

8-Methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 408394
endo-8-Methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 736442
1-Cycloheptyl-4-piperidinamine
CID 4778241
2-(2-Pyrrolidin-1-ylethyl)piperidine
CID 231871
8-(2,2,2-Trifluoroethyl)-8-azabicyclo(3.2.1)octan-3-amine dihydrochloride
CID 18919606
8-Cyclopropyl-8-azabicyclo[3.2.1]octan-3-amine
CID 45792677
(1R,3R,5S)-8-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octan-3-amine dihydrochloride
CID 70194578
N-cyclohexyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 2836880
Cambridge id 5464491
CID 784532
4-(1-Pyrrolidinyl)piperidine dihydrochloride
CID 21115585
(1R,3R,5S)-N,N-dimethyl-8-azabicyclo[3.2.1]octan-3-amine dihydrochloride
CID 91886078
3-(1-Methylpyrrolidin-2-yl)propan-1-amine dihydrochloride
CID 155943388

Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
The IUPAC name of 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride (CID 67212524) is 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride.
What is the SMILES notation for 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
The canonical SMILES for 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride is CC(C)N1C2CCC1CC(N)C2.Cl.Cl.
What is the InChIKey of 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
The InChIKey is JIVXTYIIRDPPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2.2ClH/c1-7(2)12-9-3-4-10(12)6-8(11)5-9;;/h7-10H,3-6,11H2,1-2H3;2*1H.
What are the key properties of 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride has a molecular weight of 241.21 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride is sourced from PubChem (CID 67212524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).