3-methyl-6,8-dihydro-5H-indolizin-7-one

C9H11NO — CID 5324965

IUPAC3-methyl-6,8-dihydro-5H-indolizin-7-one
SMILESCc1ccc2n1CCC(=O)C2
InChIInChI=1S/C9H11NO/c1-7-2-3-8-6-9(11)4-5-10(7)8/h2-3H,4-6H2,1H3
InChIKeyCRSMOVHFAKLWRZ-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.31
Rot. Bonds

About 3-methyl-6,8-dihydro-5H-indolizin-7-one

3-methyl-6,8-dihydro-5H-indolizin-7-one (PubChem CID 5324965) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 3-methyl-6,8-dihydro-5H-indolizin-7-one.

Molecular Properties

Compound Name3-methyl-6,8-dihydro-5H-indolizin-7-one
PubChem CID5324965
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name3-methyl-6,8-dihydro-5H-indolizin-7-one
SMILESCc1ccc2n1CCC(=O)C2
InChIInChI=1S/C9H11NO/c1-7-2-3-8-6-9(11)4-5-10(7)8/h2-3H,4-6H2,1H3
InChIKeyCRSMOVHFAKLWRZ-UHFFFAOYSA-N
XLogP1.31
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyridin-7-one
CID 83872469
3-methyl-2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyridin-7-one
CID 83892557
1-bromo-3-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyridin-7-one
CID 83893540
1-methyl-3-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyridin-7-one
CID 83878156
3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
CID 105447864
1-[(2-methylphenyl)methyl]piperidine-2,4-dione
CID 79515595
1-[(2-methylpropan-2-yl)oxy]piperidine-2,4-dione
CID 171489042
1-(2-methylpyrimidin-5-yl)piperidine-2,4-dione
CID 83819831
1-(3-methoxy-4-methylphenyl)piperidine-2,4-dione
CID 167629749
1-[(4-ethylphenyl)methyl]piperidine-2,4-dione
CID 106899915
(2E)-2-benzylidene-1-methylpiperidin-4-one
CID 175128090
1-(3,4-dimethylphenyl)piperidin-4-one
CID 24690157

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6,8-dihydro-5H-indolizin-7-one?
The IUPAC name of 3-methyl-6,8-dihydro-5H-indolizin-7-one (CID 5324965) is 3-methyl-6,8-dihydro-5H-indolizin-7-one.
What is the SMILES notation for 3-methyl-6,8-dihydro-5H-indolizin-7-one?
The canonical SMILES for 3-methyl-6,8-dihydro-5H-indolizin-7-one is Cc1ccc2n1CCC(=O)C2.
What is the InChIKey of 3-methyl-6,8-dihydro-5H-indolizin-7-one?
The InChIKey is CRSMOVHFAKLWRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-7-2-3-8-6-9(11)4-5-10(7)8/h2-3H,4-6H2,1H3.
What are the key properties of 3-methyl-6,8-dihydro-5H-indolizin-7-one?
3-methyl-6,8-dihydro-5H-indolizin-7-one has a molecular weight of 149.19 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6,8-dihydro-5H-indolizin-7-one is sourced from PubChem (CID 5324965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).