(8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine

C14H24N2 — CID 134894008

IUPAC(8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine
SMILESC(=C1\CCCN2CCC[C@H]12)\N1CCCCC1
InChIInChI=1S/C14H24N2/c1-2-8-15(9-3-1)12-13-6-4-10-16-11-5-7-14(13)16/h12,14H,1-11H2/b13-12+/t14-/m1/s1
InChIKeyUMUGLWJNLYGYEO-XTZCOPOCSA-N
MW220.36 g/mol
LogP2.61
Rot. Bonds1

About (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine

(8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine (PubChem CID 134894008) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine.

Molecular Properties

Compound Name(8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine
PubChem CID134894008
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name(8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine
SMILESC(=C1\CCCN2CCC[C@H]12)\N1CCCCC1
InChIInChI=1S/C14H24N2/c1-2-8-15(9-3-1)12-13-6-4-10-16-11-5-7-14(13)16/h12,14H,1-11H2/b13-12+/t14-/m1/s1
InChIKeyUMUGLWJNLYGYEO-XTZCOPOCSA-N
XLogP2.61
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine with MolForge

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Related Compounds

3-methyl-6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine
CID 11182699
(5R,8aR)-5-methyl-7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine
CID 11159410
(5R,8aS)-5-methyl-7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine
CID 11788391
8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine
CID 45087708
1-methylidene-3,5,6,7,8,8a-hexahydro-2H-indolizine
CID 70587294
6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine
CID 123775862
2-methylidene-3,5,6,7,8,8a-hexahydro-1H-indolizine
CID 175976037
(5S,8aS)-5-methyl-7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine
CID 11423693
(5S,8aR)-5-methyl-7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine
CID 11423694
(8aR)-8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine
CID 12185980
(5R,8aR)-7-methylidene-5-propyl-2,3,5,6,8,8a-hexahydro-1H-indolizine
CID 15410884
(5R,8aS)-7-methylidene-5-propyl-2,3,5,6,8,8a-hexahydro-1H-indolizine
CID 15410885

Frequently Asked Questions

What is the IUPAC name of (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine?
The IUPAC name of (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine (CID 134894008) is (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine.
What is the SMILES notation for (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine?
The canonical SMILES for (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine is C(=C1\CCCN2CCC[C@H]12)\N1CCCCC1.
What is the InChIKey of (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine?
The InChIKey is UMUGLWJNLYGYEO-XTZCOPOCSA-N. The full InChI is InChI=1S/C14H24N2/c1-2-8-15(9-3-1)12-13-6-4-10-16-11-5-7-14(13)16/h12,14H,1-11H2/b13-12+/t14-/m1/s1.
What are the key properties of (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine?
(8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine has a molecular weight of 220.36 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8E,8aR)-8-(piperidin-1-ylmethylidene)-2,3,5,6,7,8a-hexahydro-1H-indolizine is sourced from PubChem (CID 134894008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).