3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one

C8H10N2O — CID 641889

IUPAC3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one
SMILESCc1cnc2n(c1=O)CCC2
InChIInChI=1S/C8H10N2O/c1-6-5-9-7-3-2-4-10(7)8(6)11/h5H,2-4H2,1H3
InChIKeyQBHRODVYNZFUMW-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.50
Rot. Bonds

About 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one

3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one (PubChem CID 641889) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one
PubChem CID641889
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one
SMILESCc1cnc2n(c1=O)CCC2
InChIInChI=1S/C8H10N2O/c1-6-5-9-7-3-2-4-10(7)8(6)11/h5H,2-4H2,1H3
InChIKeyQBHRODVYNZFUMW-UHFFFAOYSA-N
XLogP0.50
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidine-3-carboxylate
CID 12778914
ethyl 4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine-3-carboxylate
CID 591709
3-acetyl-7,8-dihydro-6H-pyrrolo[2,1-c][1,2,4]triazin-4-one
CID 91983878
6-methyl-2,3-dihydro-[1,2]oxazolo[2,3-a]pyrimidin-7-one
CID 134863710
1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-2-one
CID 83827932
6-methyl-1,5,6,8-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one
CID 163363445
3-(6,9-diazaspiro[4.5]decan-6-ylmethyl)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one
CID 176681666
7-methyl-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one
CID 730195
6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine-3-carbaldehyde
CID 26967189
1-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)phenyl]-3-(3,4-dimethylphenyl)urea
CID 90557012
6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine-3-carboxylic acid;hydrochloride
CID 126796932
3-tert-butyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrazin-4-one
CID 164757517

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one?
The IUPAC name of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one (CID 641889) is 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one?
The canonical SMILES for 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one is Cc1cnc2n(c1=O)CCC2.
What is the InChIKey of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one?
The InChIKey is QBHRODVYNZFUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-6-5-9-7-3-2-4-10(7)8(6)11/h5H,2-4H2,1H3.
What are the key properties of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one?
3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one has a molecular weight of 150.18 g/mol, XLogP of 0.50, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 641889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).