4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine

C17H28N2O2 — CID 97158913

IUPAC4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine
SMILESCCc1ccc(CN2CCC[C@H](CN3CCOCC3)C2)o1
InChIInChI=1S/C17H28N2O2/c1-2-16-5-6-17(21-16)14-19-7-3-4-15(13-19)12-18-8-10-20-11-9-18/h5-6,15H,2-4,7-14H2,1H3/t15-/m1/s1
InChIKeyCMEHQFFUAJBQNM-OAHLLOKOSA-N
MW292.42 g/mol
LogP2.39
Rot. Bonds5

About 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine

4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine (PubChem CID 97158913) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine
PubChem CID97158913
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine
SMILESCCc1ccc(CN2CCC[C@H](CN3CCOCC3)C2)o1
InChIInChI=1S/C17H28N2O2/c1-2-16-5-6-17(21-16)14-19-7-3-4-15(13-19)12-18-8-10-20-11-9-18/h5-6,15H,2-4,7-14H2,1H3/t15-/m1/s1
InChIKeyCMEHQFFUAJBQNM-OAHLLOKOSA-N
XLogP2.39
TPSA28.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(9aS)-2-[(5-ethylfuran-2-yl)methyl]-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 77093175
4-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]morpholine
CID 155546801
(1R,3aR,7aR)-5-[(5-ethylfuran-2-yl)methyl]-1-(morpholin-4-ylmethyl)-3,3a,4,6,7,7a-hexahydro-1H-furo[3,4-c]pyridine;bis(2,2,2-trifluoroacetic acid)
CID 155827114
4-[[1-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]piperidin-3-yl]methyl]morpholine
CID 91646805
1-[[(3R)-1-ethylpiperidin-3-yl]methyl]-4-(furan-2-ylmethyl)piperazine
CID 124842615
(9aR)-2-[(5-ethylfuran-2-yl)methyl]-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine
CID 99930669
N,N-dimethyl-1-[4-[(5-propylfuran-2-yl)methyl]-1,4-oxazepan-6-yl]methanamine
CID 56914710
methyl 5-[[3-(methylaminomethyl)piperidin-1-yl]methyl]furan-2-carboxylate
CID 61204990
4-[[1-[(2-ethyl-1,3-thiazol-4-yl)methyl]pyrrolidin-3-yl]methyl]morpholine
CID 126781884
[5-[(3-methylpiperidin-1-yl)methyl]furan-2-yl]methanamine
CID 62438530
N-ethyl-1-[(5-ethylfuran-2-yl)methyl]pyrrolidine-3-sulfonamide
CID 75500088
[(3S)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]-(3-methylthiophen-2-yl)methanone
CID 25381246

Frequently Asked Questions

What is the IUPAC name of 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine?
The IUPAC name of 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine (CID 97158913) is 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine.
What is the SMILES notation for 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine?
The canonical SMILES for 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine is CCc1ccc(CN2CCC[C@H](CN3CCOCC3)C2)o1.
What is the InChIKey of 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine?
The InChIKey is CMEHQFFUAJBQNM-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-2-16-5-6-17(21-16)14-19-7-3-4-15(13-19)12-18-8-10-20-11-9-18/h5-6,15H,2-4,7-14H2,1H3/t15-/m1/s1.
What are the key properties of 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine?
4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine has a molecular weight of 292.42 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(3R)-1-[(5-ethylfuran-2-yl)methyl]piperidin-3-yl]methyl]morpholine is sourced from PubChem (CID 97158913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).