1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine

C15H29N3 — CID 79408013

IUPAC1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine
SMILESCC1C(N)CCN(C2CCN3CCCCC23)C1C
InChIInChI=1S/C15H29N3/c1-11-12(2)18(10-6-13(11)16)15-7-9-17-8-4-3-5-14(15)17/h11-15H,3-10,16H2,1-2H3
InChIKeyBXYVFOIDPPUEBV-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.67
Rot. Bonds1

About 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine

1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine (PubChem CID 79408013) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine
PubChem CID79408013
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine
SMILESCC1C(N)CCN(C2CCN3CCCCC23)C1C
InChIInChI=1S/C15H29N3/c1-11-12(2)18(10-6-13(11)16)15-7-9-17-8-4-3-5-14(15)17/h11-15H,3-10,16H2,1-2H3
InChIKeyBXYVFOIDPPUEBV-UHFFFAOYSA-N
XLogP1.67
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine with MolForge

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Related Compounds

1-cyclohexyl-2,3-dimethylpiperidin-4-amine
CID 79398517
1-cyclopropyl-2,3-dimethylpiperidin-4-amine
CID 79398650
1-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-4-methylpyrrolidin-3-amine
CID 103575631
cis-(1R,2S)-2-pyrrolidin-1-ylcyclohexan-1-amine;dihydrochloride
CID 66680564
2,3-dimethyl-1-(1-methylpiperidin-3-yl)piperidin-4-amine
CID 79396539
[1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-4-methoxypiperidin-2-yl]methanamine
CID 112622061
(4R,5R,9R)-9-methyl-1-azabicyclo[3.3.1]nonan-4-amine
CID 130778942
1-(1,5-diazocan-1-yl)-1,2,3,5,6,7,8,8a-octahydroindolizine
CID 54977827
(1R)-1-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
CID 16637720
trans-(1R,2R)-2-(4-methylpiperidin-1-yl)cyclopentan-1-amine
CID 30819011
2-(2,3-dimethylpiperidin-1-yl)cyclohexan-1-amine
CID 62124610
1-(1-ethylpiperidin-3-yl)-2,3-dimethylpiperidin-4-amine
CID 79397751

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine?
The IUPAC name of 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine (CID 79408013) is 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine is CC1C(N)CCN(C2CCN3CCCCC23)C1C.
What is the InChIKey of 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine?
The InChIKey is BXYVFOIDPPUEBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-11-12(2)18(10-6-13(11)16)15-7-9-17-8-4-3-5-14(15)17/h11-15H,3-10,16H2,1-2H3.
What are the key properties of 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine?
1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine has a molecular weight of 251.42 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 79408013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).