7-propyl-2,3-dihydro-1H-indolizin-5-one

C11H15NO — CID 86102422

IUPAC7-propyl-2,3-dihydro-1H-indolizin-5-one
SMILESCCCc1cc2n(c(=O)c1)CCC2
InChIInChI=1S/C11H15NO/c1-2-4-9-7-10-5-3-6-12(10)11(13)8-9/h7-8H,2-6H2,1H3
InChIKeyWXLVBHSHKUOZQR-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.75
Rot. Bonds2

About 7-propyl-2,3-dihydro-1H-indolizin-5-one

7-propyl-2,3-dihydro-1H-indolizin-5-one (PubChem CID 86102422) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 7-propyl-2,3-dihydro-1H-indolizin-5-one.

Molecular Properties

Compound Name7-propyl-2,3-dihydro-1H-indolizin-5-one
PubChem CID86102422
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name7-propyl-2,3-dihydro-1H-indolizin-5-one
SMILESCCCc1cc2n(c(=O)c1)CCC2
InChIInChI=1S/C11H15NO/c1-2-4-9-7-10-5-3-6-12(10)11(13)8-9/h7-8H,2-6H2,1H3
InChIKeyWXLVBHSHKUOZQR-UHFFFAOYSA-N
XLogP1.75
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-Dihydroindolizin-5(1H)-one
CID 13616825
6-methyl-1H,2H,3H,5H,6H-pyrrolo[2,3-c]pyridin-5-one
CID 71758441
1-ethyl-4,6-dimethyl-2(1H)-pyridone
CID 21538594
1-methyl-2,3-dihydro-1H-indolizin-5-one
CID 102163881
6-methyl-7-(trifluoromethyl)-2,3-dihydro-1H-indolizin-5-one
CID 59284256
1-fluoro-6-methyl-2,3-dihydro-1H-indolizin-5-one
CID 122623743
1-fluoro-6,8-dimethyl-2,3-dihydro-1H-indolizin-5-one
CID 122633271
1,1-Difluoro-6,8-dimethyl-2,3-dihydroindolizin-5-one
CID 122633273
1,1-Difluoro-6-methyl-2,3-dihydroindolizin-5-one
CID 122633859
1-fluoro-6-methyl-8-propan-2-yl-2,3-dihydro-1H-indolizin-5-one
CID 126608819
1-Fluoro-1,6-dimethyl-8-propan-2-yl-2,3-dihydroindolizin-5-one
CID 126608823
8-Ethyl-1,1-difluoro-6-methyl-2,3-dihydroindolizin-5-one
CID 126611910

Frequently Asked Questions

What is the IUPAC name of 7-propyl-2,3-dihydro-1H-indolizin-5-one?
The IUPAC name of 7-propyl-2,3-dihydro-1H-indolizin-5-one (CID 86102422) is 7-propyl-2,3-dihydro-1H-indolizin-5-one.
What is the SMILES notation for 7-propyl-2,3-dihydro-1H-indolizin-5-one?
The canonical SMILES for 7-propyl-2,3-dihydro-1H-indolizin-5-one is CCCc1cc2n(c(=O)c1)CCC2.
What is the InChIKey of 7-propyl-2,3-dihydro-1H-indolizin-5-one?
The InChIKey is WXLVBHSHKUOZQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-2-4-9-7-10-5-3-6-12(10)11(13)8-9/h7-8H,2-6H2,1H3.
What are the key properties of 7-propyl-2,3-dihydro-1H-indolizin-5-one?
7-propyl-2,3-dihydro-1H-indolizin-5-one has a molecular weight of 177.25 g/mol, XLogP of 1.75, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propyl-2,3-dihydro-1H-indolizin-5-one is sourced from PubChem (CID 86102422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).