2-(2-pyridin-3-ylethenyl)chromen-4-one

C16H11NO2 — CID 85443659

IUPAC2-(2-pyridin-3-ylethenyl)chromen-4-one
SMILESO=c1cc(C=Cc2cccnc2)oc2ccccc12
InChIInChI=1S/C16H11NO2/c18-15-10-13(8-7-12-4-3-9-17-11-12)19-16-6-2-1-5-14(15)16/h1-11H
InChIKeyPLCLSBMQAKEBIG-UHFFFAOYSA-N
MW249.27 g/mol
LogP3.36
Rot. Bonds2

About 2-(2-pyridin-3-ylethenyl)chromen-4-one

2-(2-pyridin-3-ylethenyl)chromen-4-one (PubChem CID 85443659) has the molecular formula C16H11NO2 and a molecular weight of 249.27 g/mol. Its IUPAC name is 2-(2-pyridin-3-ylethenyl)chromen-4-one.

Molecular Properties

Compound Name2-(2-pyridin-3-ylethenyl)chromen-4-one
PubChem CID85443659
Molecular FormulaC16H11NO2
Molecular Weight249.27 g/mol
Exact Mass249.08
IUPAC Name2-(2-pyridin-3-ylethenyl)chromen-4-one
SMILESO=c1cc(C=Cc2cccnc2)oc2ccccc12
InChIInChI=1S/C16H11NO2/c18-15-10-13(8-7-12-4-3-9-17-11-12)19-16-6-2-1-5-14(15)16/h1-11H
InChIKeyPLCLSBMQAKEBIG-UHFFFAOYSA-N
XLogP3.36
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(4-bromophenyl)ethenyl]chromen-4-one
CID 77393330
2-[(E)-2-(4-hydroxyphenyl)ethenyl]chromen-4-one
CID 6479061
2-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]chromen-4-one
CID 67991191
2-[(E)-2-(furan-2-yl)ethenyl]chromen-4-one
CID 10879170
2-[2-(1,3-benzodioxol-5-yl)ethenyl]chromen-4-one
CID 77393328
6-methyl-2-[(E)-2-phenylethenyl]chromen-4-one
CID 11499910
3-[(E)-2-[3,5-bis[(E)-2-pyridin-3-ylethenyl]phenyl]ethenyl]pyridine
CID 175663425
3-[(E)-2-pyridin-3-ylethenyl]pyridine;zinc
CID 175746701
3-[2-(furan-2-yl)ethenyl]pyridine
CID 54559781
4-(2-pyridin-3-ylethenyl)-2H-isoquinolin-1-one
CID 69207247
5,7-dihydroxy-2-[(E)-2-phenylethenyl]chromen-4-one
CID 6477679
2,3,5,6-tetrakis[(E)-2-pyridin-3-ylethenyl]pyrazine
CID 19937846

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-3-ylethenyl)chromen-4-one?
The IUPAC name of 2-(2-pyridin-3-ylethenyl)chromen-4-one (CID 85443659) is 2-(2-pyridin-3-ylethenyl)chromen-4-one.
What is the SMILES notation for 2-(2-pyridin-3-ylethenyl)chromen-4-one?
The canonical SMILES for 2-(2-pyridin-3-ylethenyl)chromen-4-one is O=c1cc(C=Cc2cccnc2)oc2ccccc12.
What is the InChIKey of 2-(2-pyridin-3-ylethenyl)chromen-4-one?
The InChIKey is PLCLSBMQAKEBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NO2/c18-15-10-13(8-7-12-4-3-9-17-11-12)19-16-6-2-1-5-14(15)16/h1-11H.
What are the key properties of 2-(2-pyridin-3-ylethenyl)chromen-4-one?
2-(2-pyridin-3-ylethenyl)chromen-4-one has a molecular weight of 249.27 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-3-ylethenyl)chromen-4-one is sourced from PubChem (CID 85443659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).