2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one

C16H15NO2 — CID 162658070

IUPAC2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one
SMILESCC1(C)C=Cc2c(c(-c3ccccc3)c[nH]c2=O)O1
InChIInChI=1S/C16H15NO2/c1-16(2)9-8-12-14(19-16)13(10-17-15(12)18)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18)
InChIKeyAHSOTZGIPQUUEO-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.23
Rot. Bonds1

About 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one

2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one (PubChem CID 162658070) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one.

Molecular Properties

Compound Name2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one
PubChem CID162658070
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one
SMILESCC1(C)C=Cc2c(c(-c3ccccc3)c[nH]c2=O)O1
InChIInChI=1S/C16H15NO2/c1-16(2)9-8-12-14(19-16)13(10-17-15(12)18)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18)
InChIKeyAHSOTZGIPQUUEO-UHFFFAOYSA-N
XLogP3.23
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,3R,6S)-4-(hydroxymethyl)-3,6-dimethyl-9-phenyl-7-oxa-11-azatricyclo[6.4.0.02,6]dodeca-1(8),4,9-trien-12-one
CID 146683006
2,2,5,6-tetramethylbenzo[h]chromene
CID 21339666
6,11-dihydroxy-3,3-dimethyl-5-phenyl-12H-pyrano[2,3-c]acridin-7-one
CID 163098872
(2R,3S,6R)-6-(hydroxymethyl)-3,4-dimethyl-9-phenyl-7-oxa-11-azatricyclo[6.4.0.02,6]dodeca-1(8),4,9-trien-12-one
CID 146683002
2,2-dimethyl-5,6,7,8-tetrahydrophenanthro[9,10-b]pyran
CID 21339668
(5E)-5-(2,2-dimethyl-6-oxobenzo[h]chromen-5-ylidene)-2,2-dimethylbenzo[h]chromen-6-one
CID 3037329
(2S)-5-hydroxy-6,8,8-trimethyl-2-phenyl-2,3-dihydropyrano[2,3-h]chromen-4-one
CID 102434194
5-bromo-4,4,10,10-tetramethyl-3,9-dioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(18),2(7),8(13),11,14,16-hexaene
CID 91144984
(2S,3R,6S)-9-(4-hydroxyphenyl)-3,4,6-trimethyl-7-oxa-11-azatricyclo[6.4.0.02,6]dodeca-1(8),4,9-trien-12-one
CID 146682998
2,2,7-trimethylpyrano[3,2-c]chromen-5-one
CID 13045727
6,6-dimethyl-7-oxapentacyclo[14.2.1.02,15.03,8.09,14]nonadeca-2(15),3(8),4,9,11,13-hexaene
CID 22970322
(7R,8R)-5,7-dihydroxy-2,2-dimethyl-6-oxo-8-phenyl-7,8-dihydropyrano[3,2-g]chromene-10-carbaldehyde
CID 54763532

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
The IUPAC name of 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one (CID 162658070) is 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one.
What is the SMILES notation for 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
The canonical SMILES for 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one is CC1(C)C=Cc2c(c(-c3ccccc3)c[nH]c2=O)O1.
What is the InChIKey of 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
The InChIKey is AHSOTZGIPQUUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-16(2)9-8-12-14(19-16)13(10-17-15(12)18)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18).
What are the key properties of 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one?
2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one has a molecular weight of 253.30 g/mol, XLogP of 3.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-8-phenyl-6H-pyrano[3,2-c]pyridin-5-one is sourced from PubChem (CID 162658070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).