3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one

C16H15NO3 — CID 15213121

IUPAC3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one
SMILESCCc1ccc2c3cc(C(C)=O)c(=O)oc3c(C)n2c1
InChIInChI=1S/C16H15NO3/c1-4-11-5-6-14-13-7-12(10(3)18)16(19)20-15(13)9(2)17(14)8-11/h5-8H,4H2,1-3H3
InChIKeyHIXPYSJIAXPYOZ-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.12
Rot. Bonds2

About 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one

3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one (PubChem CID 15213121) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one.

Molecular Properties

Compound Name3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one
PubChem CID15213121
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC Name3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one
SMILESCCc1ccc2c3cc(C(C)=O)c(=O)oc3c(C)n2c1
InChIInChI=1S/C16H15NO3/c1-4-11-5-6-14-13-7-12(10(3)18)16(19)20-15(13)9(2)17(14)8-11/h5-8H,4H2,1-3H3
InChIKeyHIXPYSJIAXPYOZ-UHFFFAOYSA-N
XLogP3.12
TPSA51.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Launch Full Analysis

Related Compounds

ethyl 10-ethyl-7-methyl-2-oxopyrano[3,2-a]indolizine-3-carboxylate
CID 15213116
7,10-dimethyl-2-oxopyrano[3,2-a]indolizine-3-carbonitrile
CID 15760071
3-acetyl-1,6-diethylquinolin-4-one
CID 58801712
1-(2-bromo-5-ethylphenyl)ethanone
CID 83988474
3-acetyl-5-methyl-7-(4-methylphenyl)chromen-2-one
CID 166066840
5-ethyl-1-methylindole-3-carboxylic acid
CID 82278766
3-acetyl-8-ethoxychromen-2-one
CID 3266617
1-(5-ethyl-3-methyl-1-benzofuran-2-yl)ethanone
CID 43155112
1-[5-bromo-1-[(4-methylphenyl)methyl]indol-3-yl]ethanone
CID 83526142
diethyl 8,9-dimethyl-2-oxopyrano[2,3-e]isoindole-3,7-dicarboxylate
CID 44582525
3-acetyl-4-hydroxy-9-methylpyrano[3,2-c]chromene-2,5-dione
CID 155521439
ethyl 3-acetyl-1-ethylindole-5-carboxylate
CID 170857395

Frequently Asked Questions

What is the IUPAC name of 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one?
The IUPAC name of 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one (CID 15213121) is 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one.
What is the SMILES notation for 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one?
The canonical SMILES for 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one is CCc1ccc2c3cc(C(C)=O)c(=O)oc3c(C)n2c1.
What is the InChIKey of 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one?
The InChIKey is HIXPYSJIAXPYOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-4-11-5-6-14-13-7-12(10(3)18)16(19)20-15(13)9(2)17(14)8-11/h5-8H,4H2,1-3H3.
What are the key properties of 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one?
3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one has a molecular weight of 269.30 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetyl-7-ethyl-10-methylpyrano[3,2-a]indolizin-2-one is sourced from PubChem (CID 15213121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).