1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline

C16H30N2O — CID 55251141

IUPAC1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
SMILESC1CCC2C(C1)CCCN2CCOC1CCNCC1
InChIInChI=1S/C16H30N2O/c1-2-6-16-14(4-1)5-3-11-18(16)12-13-19-15-7-9-17-10-8-15/h14-17H,1-13H2
InChIKeyRFUOJGWMHYUBEE-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.41
Rot. Bonds4

About 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline

1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline (PubChem CID 55251141) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline.

Molecular Properties

Compound Name1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
PubChem CID55251141
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
SMILESC1CCC2C(C1)CCCN2CCOC1CCNCC1
InChIInChI=1S/C16H30N2O/c1-2-6-16-14(4-1)5-3-11-18(16)12-13-19-15-7-9-17-10-8-15/h14-17H,1-13H2
InChIKeyRFUOJGWMHYUBEE-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline with MolForge

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Related Compounds

4-[3-(2-cyclopentylpyrrolidin-1-yl)propoxy]piperidine
CID 63903227
1-(2-methoxyethyl)-2-piperidin-4-ylazepane
CID 64851835
4-[2-(2-ethylpyrrolidin-1-yl)ethoxy]piperidine
CID 63904346
1-(2-cyclopentylpyrrolidin-1-yl)-3-piperidin-4-yloxypropan-1-one
CID 63902985
2-ethyl-1-(2-piperidin-4-yloxyethyl)azepane
CID 104690309
1-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-1,4-diazepane
CID 62832964
1-(3-methoxypropyl)-2-piperidin-4-ylazepane
CID 64852585
(3aR,7aR)-1-(2-methoxyethyl)-2,3,3a,4,5,6,7,7a-octahydroindole
CID 130723594
5-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]pentane-1-thiol
CID 102729051
1-(2-cyclohexyloxyethyl)-1,5-diazocane
CID 63826545
1-ethyl-2-piperidin-4-ylazepane
CID 64852207
6-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]hexane-1-thiol
CID 102729068

Frequently Asked Questions

What is the IUPAC name of 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline?
The IUPAC name of 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline (CID 55251141) is 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline.
What is the SMILES notation for 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline?
The canonical SMILES for 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline is C1CCC2C(C1)CCCN2CCOC1CCNCC1.
What is the InChIKey of 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline?
The InChIKey is RFUOJGWMHYUBEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-6-16-14(4-1)5-3-11-18(16)12-13-19-15-7-9-17-10-8-15/h14-17H,1-13H2.
What are the key properties of 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline?
1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline has a molecular weight of 266.43 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-piperidin-4-yloxyethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline is sourced from PubChem (CID 55251141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).