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

C8H10N2O — CID 5319799

IUPAC3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one
SMILESCc1cn2c(nc1=O)CCC2
InChIInChI=1S/C8H10N2O/c1-6-5-10-4-2-3-7(10)9-8(6)11/h5H,2-4H2,1H3
InChIKeyKRYURACLPUIPBO-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.50
Rot. Bonds

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

3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one (PubChem CID 5319799) 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-2-one.

Molecular Properties

Compound Name3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one
PubChem CID5319799
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one
SMILESCc1cn2c(nc1=O)CCC2
InChIInChI=1S/C8H10N2O/c1-6-5-10-4-2-3-7(10)9-8(6)11/h5H,2-4H2,1H3
InChIKeyKRYURACLPUIPBO-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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Frequently Asked Questions

What is the IUPAC name of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one?
The IUPAC name of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one (CID 5319799) is 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one.
What is the SMILES notation for 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one?
The canonical SMILES for 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one is Cc1cn2c(nc1=O)CCC2.
What is the InChIKey of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one?
The InChIKey is KRYURACLPUIPBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-6-5-10-4-2-3-7(10)9-8(6)11/h5H,2-4H2,1H3.
What are the key properties of 3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-one?
3-methyl-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-2-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-2-one is sourced from PubChem (CID 5319799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).