6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol

C20H20N2O2 — CID 175999767

IUPAC6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol
SMILESOc1ccc(/C=C/c2cn(C3CCCCO3)c3ccccc23)nc1
InChIInChI=1S/C20H20N2O2/c23-17-11-10-16(21-13-17)9-8-15-14-22(20-7-3-4-12-24-20)19-6-2-1-5-18(15)19/h1-2,5-6,8-11,13-14,20,23H,3-4,7,12H2/b9-8+
InChIKeyCMAMJHOTOIEFMX-CMDGGOBGSA-N
MW320.39 g/mol
LogP4.61
Rot. Bonds3

About 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol

6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol (PubChem CID 175999767) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol
PubChem CID175999767
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol
SMILESOc1ccc(/C=C/c2cn(C3CCCCO3)c3ccccc23)nc1
InChIInChI=1S/C20H20N2O2/c23-17-11-10-16(21-13-17)9-8-15-14-22(20-7-3-4-12-24-20)19-6-2-1-5-18(15)19/h1-2,5-6,8-11,13-14,20,23H,3-4,7,12H2/b9-8+
InChIKeyCMAMJHOTOIEFMX-CMDGGOBGSA-N
XLogP4.61
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-(oxolan-2-yl)indole-3-carboxylate
CID 122385558
1-(oxan-2-yl)-3-[(E)-2-[5-(pyrrolidin-1-ylmethyl)-2-pyridinyl]ethenyl]indazole
CID 175999633
3-chloro-1-(oxan-2-yl)indazole
CID 66909910
1-[(2S)-oxan-2-yl]indazole
CID 124562379
N-[2-[(E)-2-[1-(oxan-2-yl)indazol-3-yl]ethenyl]phenyl]pyridin-2-amine
CID 68998017
1-[1-(oxan-2-yl)benzimidazol-2-yl]ethanone
CID 22478048
6-fluoro-1-(oxan-2-yl)benzimidazole
CID 141364724
3-bromo-1-(oxolan-2-yl)indazole
CID 175417503
6-[(E)-2-(4-hydroxyphenyl)ethenyl]pyridin-3-ol
CID 135503118
4-methoxy-1-(oxan-2-yl)benzimidazole-5-carbaldehyde
CID 86694690
3-ethyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyridin-5-ol
CID 171465891
[1-[(2S)-oxan-2-yl]indazol-4-yl]boronic acid
CID 125117039

Frequently Asked Questions

What is the IUPAC name of 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol?
The IUPAC name of 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol (CID 175999767) is 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol.
What is the SMILES notation for 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol?
The canonical SMILES for 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol is Oc1ccc(/C=C/c2cn(C3CCCCO3)c3ccccc23)nc1.
What is the InChIKey of 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol?
The InChIKey is CMAMJHOTOIEFMX-CMDGGOBGSA-N. The full InChI is InChI=1S/C20H20N2O2/c23-17-11-10-16(21-13-17)9-8-15-14-22(20-7-3-4-12-24-20)19-6-2-1-5-18(15)19/h1-2,5-6,8-11,13-14,20,23H,3-4,7,12H2/b9-8+.
What are the key properties of 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol?
6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol has a molecular weight of 320.39 g/mol, XLogP of 4.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(E)-2-[1-(oxan-2-yl)indol-3-yl]ethenyl]pyridin-3-ol is sourced from PubChem (CID 175999767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).