2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine

C13H21N3 — CID 98111976

IUPAC2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine
SMILESNc1c([C@H]2CCCNC2)cc2n1CCCC2
InChIInChI=1S/C13H21N3/c14-13-12(10-4-3-6-15-9-10)8-11-5-1-2-7-16(11)13/h8,10,15H,1-7,9,14H2/t10-/m0/s1
InChIKeyGLBCBXAETBIBEI-JTQLQIEISA-N
MW219.33 g/mol
LogP1.87
Rot. Bonds1

About 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine

2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine (PubChem CID 98111976) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine.

Molecular Properties

Compound Name2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine
PubChem CID98111976
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine
SMILESNc1c([C@H]2CCCNC2)cc2n1CCCC2
InChIInChI=1S/C13H21N3/c14-13-12(10-4-3-6-15-9-10)8-11-5-1-2-7-16(11)13/h8,10,15H,1-7,9,14H2/t10-/m0/s1
InChIKeyGLBCBXAETBIBEI-JTQLQIEISA-N
XLogP1.87
TPSA42.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4,5-dimethyl-2-piperidin-3-ylaniline
CID 166143865
7-piperidin-3-yl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene
CID 116993221
3-amino-4-[(3S)-piperidin-3-yl]phenol
CID 130631075
2,6-dimethyl-3-piperidin-3-ylpyridine
CID 82603619
4,6-dimethyl-2-piperidin-3-ylpyrimidine
CID 63317441
3-chloro-4-piperidin-3-ylphenol
CID 82612870
3-(2,3,4,5-tetrafluorophenyl)piperidine
CID 117116503
3-(4-bromofuran-3-yl)piperidine
CID 82390956
4,6-dimethyl-2-piperidin-3-ylpyrimidine;dihydrochloride
CID 71299007
1-(2,5-dimethoxy-4-piperidin-3-ylphenyl)piperidine
CID 117489901
9-methyl-2-piperidin-3-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 115054823
3-(2,4-dimethylphenyl)piperidine
CID 10535662

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine?
The IUPAC name of 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine (CID 98111976) is 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine.
What is the SMILES notation for 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine?
The canonical SMILES for 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine is Nc1c([C@H]2CCCNC2)cc2n1CCCC2.
What is the InChIKey of 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine?
The InChIKey is GLBCBXAETBIBEI-JTQLQIEISA-N. The full InChI is InChI=1S/C13H21N3/c14-13-12(10-4-3-6-15-9-10)8-11-5-1-2-7-16(11)13/h8,10,15H,1-7,9,14H2/t10-/m0/s1.
What are the key properties of 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine?
2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 1.87, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-piperidin-3-yl]-5,6,7,8-tetrahydroindolizin-3-amine is sourced from PubChem (CID 98111976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).