2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone

C19H23N3O3 — CID 129006594

IUPAC2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone
SMILESO=C(Cc1ccoc1)N1CCC(Oc2cccnc2N2CCCC2)C1
InChIInChI=1S/C19H23N3O3/c23-18(12-15-6-11-24-14-15)22-10-5-16(13-22)25-17-4-3-7-20-19(17)21-8-1-2-9-21/h3-4,6-7,11,14,16H,1-2,5,8-10,12-13H2
InChIKeySAJNVGHVJUGIIL-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.50
Rot. Bonds5

About 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone

2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone (PubChem CID 129006594) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone.

Molecular Properties

Compound Name2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone
PubChem CID129006594
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone
SMILESO=C(Cc1ccoc1)N1CCC(Oc2cccnc2N2CCCC2)C1
InChIInChI=1S/C19H23N3O3/c23-18(12-15-6-11-24-14-15)22-10-5-16(13-22)25-17-4-3-7-20-19(17)21-8-1-2-9-21/h3-4,6-7,11,14,16H,1-2,5,8-10,12-13H2
InChIKeySAJNVGHVJUGIIL-UHFFFAOYSA-N
XLogP2.50
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(6-methyl-3-pyridinyl)-1-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone
CID 129475234
2-(2-methyl-1,3-thiazol-4-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone
CID 128973759
2-ethylsulfonyl-1-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone
CID 129476531
1-[(3R)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]-2-(triazol-1-yl)ethanone
CID 129329728
(5-chlorofuran-2-yl)-[(3R)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 129332964
3-[2-oxo-2-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethyl]-1,3-thiazolidin-4-one
CID 129006642
(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]-N-(2-pyrrol-1-ylethyl)pyrrolidine-1-carboxamide
CID 129478495
2-chloro-1-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]propan-1-one
CID 146095016
pyrazin-2-yl-[(3R)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 129472960
(3-aminopyrazin-2-yl)-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 129475897
(3R)-N-(1-methylpiperidin-4-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide
CID 129472588
(1,3-dimethylpyrazol-4-yl)-[(3R)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 129473052

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone?
The IUPAC name of 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone (CID 129006594) is 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone.
What is the SMILES notation for 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone?
The canonical SMILES for 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone is O=C(Cc1ccoc1)N1CCC(Oc2cccnc2N2CCCC2)C1.
What is the InChIKey of 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone?
The InChIKey is SAJNVGHVJUGIIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c23-18(12-15-6-11-24-14-15)22-10-5-16(13-22)25-17-4-3-7-20-19(17)21-8-1-2-9-21/h3-4,6-7,11,14,16H,1-2,5,8-10,12-13H2.
What are the key properties of 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone?
2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone has a molecular weight of 341.41 g/mol, XLogP of 2.50, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-1-[3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 129006594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).