1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol

C18H25NO5 — CID 111434957

IUPAC1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol
SMILESCCc1ccc(C2COCCN2CC(O)COCc2ccco2)o1
InChIInChI=1S/C18H25NO5/c1-2-15-5-6-18(24-15)17-13-21-9-7-19(17)10-14(20)11-22-12-16-4-3-8-23-16/h3-6,8,14,17,20H,2,7,9-13H2,1H3
InChIKeyGJBGPUKELTXPPF-UHFFFAOYSA-N
MW335.40 g/mol
LogP2.39
Rot. Bonds8

About 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol

1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol (PubChem CID 111434957) has the molecular formula C18H25NO5 and a molecular weight of 335.40 g/mol. Its IUPAC name is 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol.

Molecular Properties

Compound Name1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol
PubChem CID111434957
Molecular FormulaC18H25NO5
Molecular Weight335.40 g/mol
Exact Mass335.17
IUPAC Name1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol
SMILESCCc1ccc(C2COCCN2CC(O)COCc2ccco2)o1
InChIInChI=1S/C18H25NO5/c1-2-15-5-6-18(24-15)17-13-21-9-7-19(17)10-14(20)11-22-12-16-4-3-8-23-16/h3-6,8,14,17,20H,2,7,9-13H2,1H3
InChIKeyGJBGPUKELTXPPF-UHFFFAOYSA-N
XLogP2.39
TPSA68.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(furan-2-ylmethoxy)-3-[4-(1-hydroxyethyl)piperidin-1-yl]propan-2-ol
CID 111116661
(2S)-1-(furan-2-ylmethoxy)-3-pyrrolidin-1-ylpropan-2-ol
CID 942774
(2R)-1-[(4R)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-3-(furan-2-ylmethoxy)propan-2-ol
CID 100841540
1-[(2R)-2-[(2S)-1-[(2S)-3-(furan-2-ylmethoxy)-2-hydroxypropyl]pyrrolidin-2-yl]pyrrolidin-1-yl]ethanone
CID 95316604
1-(furan-2-ylmethoxy)-3-pyrrolidin-1-ylpropan-2-ol
CID 2771920
(2S)-1-(furan-2-ylmethoxy)-3-[(3S)-4-[(2S)-2-hydroxypropyl]-3-methylpiperazin-1-yl]propan-2-ol
CID 124778946
(2S)-1-(furan-2-ylmethoxy)-3-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]propan-2-ol
CID 95343819
1-(2-ethylimidazol-1-yl)-3-(furan-2-ylmethoxy)propan-2-ol
CID 109411210
1-(8-azaspiro[4.5]decan-8-yl)-3-(furan-2-ylmethoxy)propan-2-ol
CID 111437430
1-[4-(4-chlorophenyl)piperazin-1-yl]-3-(furan-2-ylmethoxy)propan-2-ol
CID 3681676
1-[3-(furan-2-ylmethoxy)-2-hydroxypropyl]-N,N-dimethylpiperidine-4-carboxamide
CID 110882093
(3S)-2-[(2R)-3-(furan-2-ylmethoxy)-2-hydroxypropyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 100852297

Frequently Asked Questions

What is the IUPAC name of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol?
The IUPAC name of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol (CID 111434957) is 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol.
What is the SMILES notation for 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol?
The canonical SMILES for 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol is CCc1ccc(C2COCCN2CC(O)COCc2ccco2)o1.
What is the InChIKey of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol?
The InChIKey is GJBGPUKELTXPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO5/c1-2-15-5-6-18(24-15)17-13-21-9-7-19(17)10-14(20)11-22-12-16-4-3-8-23-16/h3-6,8,14,17,20H,2,7,9-13H2,1H3.
What are the key properties of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol?
1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol has a molecular weight of 335.40 g/mol, XLogP of 2.39, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-3-(furan-2-ylmethoxy)propan-2-ol is sourced from PubChem (CID 111434957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).