8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

C14H28N2 — CID 62741055

IUPAC8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCCN1C2CCC1CC(NCCC)C2
InChIInChI=1S/C14H28N2/c1-3-5-9-16-13-6-7-14(16)11-12(10-13)15-8-4-2/h12-15H,3-11H2,1-2H3
InChIKeyYUGBSTYPOZZVKR-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.78
Rot. Bonds6

About 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 62741055) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID62741055
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCCN1C2CCC1CC(NCCC)C2
InChIInChI=1S/C14H28N2/c1-3-5-9-16-13-6-7-14(16)11-12(10-13)15-8-4-2/h12-15H,3-11H2,1-2H3
InChIKeyYUGBSTYPOZZVKR-UHFFFAOYSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-(4-methoxybutyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62738979
8-[(1-methylpiperidin-4-yl)methyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62740031
8-[2-(3-methylbutoxy)ethyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62740388
9-[(E)-pent-3-enyl]-N-propyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 113466133
8-propan-2-yl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62738418
8-(oxolan-2-ylmethyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 55106138
N-[3-[3-(ethylamino)-8-azabicyclo[3.2.1]octan-8-yl]propyl]methanesulfonamide
CID 106338448
8-(oxolan-3-ylmethyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62824400
9-[2-(oxolan-2-yl)ethyl]-N-propyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 62713145
8-[(4-chlorophenyl)methyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62739990
8-(2,6-dimethylpiperidin-1-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 83024323
8-(3-methylbutan-2-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62738581

Frequently Asked Questions

What is the IUPAC name of 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (CID 62741055) is 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is CCCCN1C2CCC1CC(NCCC)C2.
What is the InChIKey of 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is YUGBSTYPOZZVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-5-9-16-13-6-7-14(16)11-12(10-13)15-8-4-2/h12-15H,3-11H2,1-2H3.
What are the key properties of 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 224.39 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-butyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 62741055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).