8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

C17H33N3 — CID 62738636

IUPAC8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCNC1CC2CCC(C1)N2C1CCCN(CC)C1
InChIInChI=1S/C17H33N3/c1-3-9-18-14-11-15-7-8-16(12-14)20(15)17-6-5-10-19(4-2)13-17/h14-18H,3-13H2,1-2H3
InChIKeyUFIXRONDOYADDC-UHFFFAOYSA-N
MW279.47 g/mol
LogP2.47
Rot. Bonds5

About 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 62738636) has the molecular formula C17H33N3 and a molecular weight of 279.47 g/mol. Its IUPAC name is 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID62738636
Molecular FormulaC17H33N3
Molecular Weight279.47 g/mol
Exact Mass279.27
IUPAC Name8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCNC1CC2CCC(C1)N2C1CCCN(CC)C1
InChIInChI=1S/C17H33N3/c1-3-9-18-14-11-15-7-8-16(12-14)20(15)17-6-5-10-19(4-2)13-17/h14-18H,3-13H2,1-2H3
InChIKeyUFIXRONDOYADDC-UHFFFAOYSA-N
XLogP2.47
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.47
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine with MolForge

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Related Compounds

9-cyclopentyl-N-propyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 62711986
N-propyl-8-(1-propylpiperidin-4-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 62740549
3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine
CID 79642695
8-(2-methylcyclopentyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 63281615
N-ethyl-9-(1-methylpiperidin-3-yl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 62713820
1-(2-aminoethyl)-N-propylpiperidin-3-amine
CID 83991380
8-cycloheptyl-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62738438
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
3-(2-methylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine
CID 79630966
8-propan-2-yl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62738418
8-(1-ethylazepan-4-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 65077683

Frequently Asked Questions

What is the IUPAC name of 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (CID 62738636) is 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is CCCNC1CC2CCC(C1)N2C1CCCN(CC)C1.
What is the InChIKey of 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is UFIXRONDOYADDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3/c1-3-9-18-14-11-15-7-8-16(12-14)20(15)17-6-5-10-19(4-2)13-17/h14-18H,3-13H2,1-2H3.
What are the key properties of 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 279.47 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-ethylpiperidin-3-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 62738636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).