3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole

C11H20N2O2 — CID 172642973

IUPAC3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole
SMILESC1CN(CC23CNCC2COC3)CCO1
InChIInChI=1S/C11H20N2O2/c1-3-14-4-2-13(1)8-11-7-12-5-10(11)6-15-9-11/h10,12H,1-9H2
InChIKeyIMQPKIHPXFXJJR-UHFFFAOYSA-N
MW212.29 g/mol
LogP-0.45
Rot. Bonds2

About 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole

3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole (PubChem CID 172642973) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole.

Molecular Properties

Compound Name3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole
PubChem CID172642973
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole
SMILESC1CN(CC23CNCC2COC3)CCO1
InChIInChI=1S/C11H20N2O2/c1-3-14-4-2-13(1)8-11-7-12-5-10(11)6-15-9-11/h10,12H,1-9H2
InChIKeyIMQPKIHPXFXJJR-UHFFFAOYSA-N
XLogP-0.45
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(2-morpholin-4-ylethyl)-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-yl]methanol
CID 137344705
1-[[3-(oxan-4-yl)oxetan-3-yl]methyl]piperazine
CID 116873103
(3aR,6aS)-3a-[(4-imidazo[2,1-b][1,3]thiazol-6-yl-4-phenylpiperidin-1-yl)methyl]-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole
CID 165423414
3-(morpholin-4-ylmethyl)pyrrolidin-3-ol;dihydrochloride
CID 146675400
(3aR,6aR)-3a-(pyridin-4-ylmethoxymethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole;dihydrochloride
CID 155833667
[(3aS,6aS)-3a-(morpholin-4-ylmethyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-5-yl]-(3-methyl-1,2-oxazol-5-yl)methanone
CID 124912729
(3aR,6aR)-3a-(morpholin-4-ylmethyl)-5-pyridin-3-ylsulfonyl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrole
CID 97420503
4-(azetidin-3-ylmethyl)morpholine
CID 66596271
1-[2-[3-(oxan-4-yl)oxetan-3-yl]ethyl]piperazine
CID 116873116
4-(4,4-dimethylpyrrolidin-3-yl)morpholine
CID 91666792
(3aS,6aR)-3a-(cyclopentylmethoxymethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole;2,2,2-trifluoroacetic acid
CID 155859597
[(3aR,6aR)-3a-(morpholin-4-ylmethyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-5-yl]-(cyclopenten-1-yl)methanone;2,2,2-trifluoroacetic acid
CID 155842714

Frequently Asked Questions

What is the IUPAC name of 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole?
The IUPAC name of 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole (CID 172642973) is 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole.
What is the SMILES notation for 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole?
The canonical SMILES for 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole is C1CN(CC23CNCC2COC3)CCO1.
What is the InChIKey of 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole?
The InChIKey is IMQPKIHPXFXJJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-14-4-2-13(1)8-11-7-12-5-10(11)6-15-9-11/h10,12H,1-9H2.
What are the key properties of 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole?
3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole has a molecular weight of 212.29 g/mol, XLogP of -0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3a-(morpholin-4-ylmethyl)-1,3,4,5,6,6a-hexahydrofuro[3,4-c]pyrrole is sourced from PubChem (CID 172642973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).