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

C16H31N3 — CID 81298387

IUPACN-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
SMILESCC1CN(C)C(C)CC1NC1CCN2CCCC2C1
InChIInChI=1S/C16H31N3/c1-12-11-18(3)13(2)9-16(12)17-14-6-8-19-7-4-5-15(19)10-14/h12-17H,4-11H2,1-3H3
InChIKeyVCGVZKQWRRCPOB-UHFFFAOYSA-N
MW265.44 g/mol
LogP1.93
Rot. Bonds2

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

N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine (PubChem CID 81298387) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine.

Molecular Properties

Compound NameN-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
PubChem CID81298387
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC NameN-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
SMILESCC1CN(C)C(C)CC1NC1CCN2CCCC2C1
InChIInChI=1S/C16H31N3/c1-12-11-18(3)13(2)9-16(12)17-14-6-8-19-7-4-5-15(19)10-14/h12-17H,4-11H2,1-3H3
InChIKeyVCGVZKQWRRCPOB-UHFFFAOYSA-N
XLogP1.93
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

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Related Compounds

(2R,4S,5R)-N-cyclopentyl-1,2,5-trimethylpiperidin-4-amine
CID 93258430
1,2,5-trimethyl-N-(3-methylcyclopentyl)piperidin-4-amine
CID 114543938
N-(2-ethylcyclopentyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 115709909
1,2,5-trimethyl-N-(2-methyloxan-4-yl)piperidin-4-amine
CID 113349438
1,2,5-trimethyl-N-[3-(trifluoromethyl)cyclohexyl]piperidin-4-amine
CID 43747487
N-(1,3-dimethylpiperidin-4-yl)-1,2,5-trimethylpiperidin-4-amine
CID 113261212
N-(2,2-dimethyloxan-4-yl)-1,2,5-trimethylpiperidin-4-amine
CID 83032693
N-(4-propylcyclohexyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 112728588
N-(3-propan-2-ylcyclohexyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 103847608
(2S)-1-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-ylamino)propan-2-ol
CID 103906359
N-(1-cyclopropylpyrrolidin-3-yl)-1,5-dimethylpyrrolidin-3-amine
CID 81344811
N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 112728592

Frequently Asked Questions

What is the IUPAC name of N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
The IUPAC name of N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine (CID 81298387) is N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine.
What is the SMILES notation for N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
The canonical SMILES for N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine is CC1CN(C)C(C)CC1NC1CCN2CCCC2C1.
What is the InChIKey of N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
The InChIKey is VCGVZKQWRRCPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-12-11-18(3)13(2)9-16(12)17-14-6-8-19-7-4-5-15(19)10-14/h12-17H,4-11H2,1-3H3.
What are the key properties of N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine?
N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine has a molecular weight of 265.44 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,5-trimethylpiperidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine is sourced from PubChem (CID 81298387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).