6,7-dihydro-5H-indolizin-3-one

C8H9NO — CID 15521415

IUPAC6,7-dihydro-5H-indolizin-3-one
SMILESO=C1C=CC2=CCCCN12
InChIInChI=1S/C8H9NO/c10-8-5-4-7-3-1-2-6-9(7)8/h3-5H,1-2,6H2
InChIKeyPMICPBCLWQIMMZ-UHFFFAOYSA-N
MW135.17 g/mol
LogP1.06
Rot. Bonds

About 6,7-dihydro-5H-indolizin-3-one

6,7-dihydro-5H-indolizin-3-one (PubChem CID 15521415) has the molecular formula C8H9NO and a molecular weight of 135.17 g/mol. Its IUPAC name is 6,7-dihydro-5H-indolizin-3-one.

Molecular Properties

Compound Name6,7-dihydro-5H-indolizin-3-one
PubChem CID15521415
Molecular FormulaC8H9NO
Molecular Weight135.17 g/mol
Exact Mass135.07
IUPAC Name6,7-dihydro-5H-indolizin-3-one
SMILESO=C1C=CC2=CCCCN12
InChIInChI=1S/C8H9NO/c10-8-5-4-7-3-1-2-6-9(7)8/h3-5H,1-2,6H2
InChIKeyPMICPBCLWQIMMZ-UHFFFAOYSA-N
XLogP1.06
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2E,4E,6Z)-2,4,6-Decatrienoic acid dehydropiperidide
CID 131751449
(2E,4E,6E)-1-(3,4-dihydro-2H-pyridin-1-yl)deca-2,4,6-trien-1-one
CID 14427403
Pyridine, 1,2,3,4-tetrahydro-1-(1-oxo-2,4,6-decatrienyl)-, (E,E,Z)-
CID 14427404
(2E,4E,8Z)-1-(3,4-dihydro-2H-pyridin-1-yl)deca-2,4,8-trien-1-one
CID 14427408
Pyridine, 1,2,3,4-tetrahydro-1-(1-oxo-2,4,6-decatrienyl)-, (E,E,Z)-(9CI)
CID 72731314
1-(3,4-dihydro-2H-pyridin-1-yl)deca-2,4,8-trien-1-one
CID 72731316
2,3-Dihydroindolizin-5(1H)-one
CID 13616825
6,7,8,9-Tetrahydroquinolizin-4-one
CID 13616826
7,8,9,10-Tetrahydropyrido[1,2-a]azepin-4(6H)-one
CID 13616830
3(2h)-Indolizinone
CID 19815254
(3h)N-phenylmaleimide
CID 88997504
1-methyl-2,3-dihydro-1H-indolizin-5-one
CID 102163881

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-indolizin-3-one?
The IUPAC name of 6,7-dihydro-5H-indolizin-3-one (CID 15521415) is 6,7-dihydro-5H-indolizin-3-one.
What is the SMILES notation for 6,7-dihydro-5H-indolizin-3-one?
The canonical SMILES for 6,7-dihydro-5H-indolizin-3-one is O=C1C=CC2=CCCCN12.
What is the InChIKey of 6,7-dihydro-5H-indolizin-3-one?
The InChIKey is PMICPBCLWQIMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO/c10-8-5-4-7-3-1-2-6-9(7)8/h3-5H,1-2,6H2.
What are the key properties of 6,7-dihydro-5H-indolizin-3-one?
6,7-dihydro-5H-indolizin-3-one has a molecular weight of 135.17 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-indolizin-3-one is sourced from PubChem (CID 15521415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).