6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one

C15H13NO2 — CID 10681458

IUPAC6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one
SMILESCc1ccc2c(c1)C(=O)CC(c1cccnc1)O2
InChIInChI=1S/C15H13NO2/c1-10-4-5-14-12(7-10)13(17)8-15(18-14)11-3-2-6-16-9-11/h2-7,9,15H,8H2,1H3
InChIKeyOPTBVEXKKYLYKD-UHFFFAOYSA-N
MW239.27 g/mol
LogP3.10
Rot. Bonds1

About 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one

6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one (PubChem CID 10681458) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one
PubChem CID10681458
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one
SMILESCc1ccc2c(c1)C(=O)CC(c1cccnc1)O2
InChIInChI=1S/C15H13NO2/c1-10-4-5-14-12(7-10)13(17)8-15(18-14)11-3-2-6-16-9-11/h2-7,9,15H,8H2,1H3
InChIKeyOPTBVEXKKYLYKD-UHFFFAOYSA-N
XLogP3.10
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one?
The IUPAC name of 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one (CID 10681458) is 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one.
What is the SMILES notation for 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one?
The canonical SMILES for 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one is Cc1ccc2c(c1)C(=O)CC(c1cccnc1)O2.
What is the InChIKey of 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one?
The InChIKey is OPTBVEXKKYLYKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-10-4-5-14-12(7-10)13(17)8-15(18-14)11-3-2-6-16-9-11/h2-7,9,15H,8H2,1H3.
What are the key properties of 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one?
6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one has a molecular weight of 239.27 g/mol, XLogP of 3.10, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-pyridin-3-yl-2,3-dihydrochromen-4-one is sourced from PubChem (CID 10681458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).