(8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine

C8H16N2 — CID 168842320

IUPAC(8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
SMILESC[C@H]1CCCN2CCNC12
InChIInChI=1S/C8H16N2/c1-7-3-2-5-10-6-4-9-8(7)10/h7-9H,2-6H2,1H3/t7-,8?/m0/s1
InChIKeyILPNHIQHBWHWST-JAMMHHFISA-N
MW140.23 g/mol
LogP0.65
Rot. Bonds

About (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine

(8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine (PubChem CID 168842320) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name(8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
PubChem CID168842320
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
SMILESC[C@H]1CCCN2CCNC12
InChIInChI=1S/C8H16N2/c1-7-3-2-5-10-6-4-9-8(7)10/h7-9H,2-6H2,1H3/t7-,8?/m0/s1
InChIKeyILPNHIQHBWHWST-JAMMHHFISA-N
XLogP0.65
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine
CID 44827712
1-(2,6-dimethylcyclohexyl)-3-methylpiperazine
CID 65416353
(1S,2R)-3,7,10,14-tetrazatricyclo[8.4.0.02,7]tetradecane
CID 10867261
(8aR)-8-methyl-1,2,3,5,6,7,8,8a-octahydroindolizine
CID 155305626
8-methyl-2-(4-methylcyclohexyl)-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
CID 163152023
1-[(1R,2S)-2-methylcyclohexyl]piperazine
CID 796159
(1R)-1-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
CID 16637720
(2R,4S)-2-methyl-4-pyrrolidin-1-ylpiperidine;dihydrochloride
CID 67314544
(3R)-1-cycloheptyl-3-methylpiperazine
CID 95437868
1-cyclopropyl-3-methylpiperazine
CID 64926788
3,7,9,13-tetrazatricyclo[7.4.0.02,7]tridecane
CID 58681478
3-methyl-1-piperidin-4-ylpiperidine
CID 2760044

Frequently Asked Questions

What is the IUPAC name of (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
The IUPAC name of (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine (CID 168842320) is (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
The canonical SMILES for (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine is C[C@H]1CCCN2CCNC12.
What is the InChIKey of (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
The InChIKey is ILPNHIQHBWHWST-JAMMHHFISA-N. The full InChI is InChI=1S/C8H16N2/c1-7-3-2-5-10-6-4-9-8(7)10/h7-9H,2-6H2,1H3/t7-,8?/m0/s1.
What are the key properties of (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine?
(8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine has a molecular weight of 140.23 g/mol, XLogP of 0.65, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-8-methyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 168842320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).