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

C17H34N2 — CID 43694218

IUPACN-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
SMILESCC(C)CC(CC(C)C)NC1CCN2CCCCC12
InChIInChI=1S/C17H34N2/c1-13(2)11-15(12-14(3)4)18-16-8-10-19-9-6-5-7-17(16)19/h13-18H,5-12H2,1-4H3
InChIKeyFSGXTVCGSZWGQJ-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.66
Rot. Bonds6

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

N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (PubChem CID 43694218) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine.

Molecular Properties

Compound NameN-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
PubChem CID43694218
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC NameN-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
SMILESCC(C)CC(CC(C)C)NC1CCN2CCCCC12
InChIInChI=1S/C17H34N2/c1-13(2)11-15(12-14(3)4)18-16-8-10-19-9-6-5-7-17(16)19/h13-18H,5-12H2,1-4H3
InChIKeyFSGXTVCGSZWGQJ-UHFFFAOYSA-N
XLogP3.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine?
The IUPAC name of N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (CID 43694218) is N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine.
What is the SMILES notation for N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine?
The canonical SMILES for N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine is CC(C)CC(CC(C)C)NC1CCN2CCCCC12.
What is the InChIKey of N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine?
The InChIKey is FSGXTVCGSZWGQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13(2)11-15(12-14(3)4)18-16-8-10-19-9-6-5-7-17(16)19/h13-18H,5-12H2,1-4H3.
What are the key properties of N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine?
N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylheptan-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine is sourced from PubChem (CID 43694218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).