4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine

C14H26N2O — CID 176920884

IUPAC4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine
SMILESCCC12CCCN1C(CN1CCOCC1)CC2
InChIInChI=1S/C14H26N2O/c1-2-14-5-3-7-16(14)13(4-6-14)12-15-8-10-17-11-9-15/h13H,2-12H2,1H3
InChIKeyRWQDBRDVPAJKDH-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.73
Rot. Bonds3

About 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine

4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine (PubChem CID 176920884) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine
PubChem CID176920884
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine
SMILESCCC12CCCN1C(CN1CCOCC1)CC2
InChIInChI=1S/C14H26N2O/c1-2-14-5-3-7-16(14)13(4-6-14)12-15-8-10-17-11-9-15/h13H,2-12H2,1H3
InChIKeyRWQDBRDVPAJKDH-UHFFFAOYSA-N
XLogP1.73
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R,8R)-8-(2-methylpropyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methyl morpholine-4-carboxylate
CID 176748028
2,2-dimethyl-6-(morpholin-4-ylmethyl)cyclohexan-1-ol
CID 79848658
(3S,8S)-8-(ethoxymethyl)-3-(fluoromethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 169255735
[(3S,8R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanamine
CID 177217439
4-[(2-methylcyclobutyl)methyl]morpholine
CID 67036054
8-ethyl-1,2,3,5,6,7-hexahydropyrrolizine;hydrofluoride
CID 168881533
4-[(2-ethyl-2-methyl-1,3-dioxolan-4-yl)methyl]morpholine
CID 13264215
[8-(methylaminomethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanol
CID 167179789
4-(cyclohexylmethyl)morpholine
CID 641545
4-[(5,5-dimethyloxolan-2-yl)methyl]morpholine
CID 130167785
[1-(3-ethylmorpholin-4-yl)cycloheptyl]methanamine
CID 43613015
4-(oxan-4-ylmethyl)morpholine
CID 122244931

Frequently Asked Questions

What is the IUPAC name of 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine?
The IUPAC name of 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine (CID 176920884) is 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine.
What is the SMILES notation for 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine?
The canonical SMILES for 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine is CCC12CCCN1C(CN1CCOCC1)CC2.
What is the InChIKey of 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine?
The InChIKey is RWQDBRDVPAJKDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-14-5-3-7-16(14)13(4-6-14)12-15-8-10-17-11-9-15/h13H,2-12H2,1H3.
What are the key properties of 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine?
4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine has a molecular weight of 238.37 g/mol, XLogP of 1.73, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(8-ethyl-1,2,3,5,6,7-hexahydropyrrolizin-3-yl)methyl]morpholine is sourced from PubChem (CID 176920884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).