6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one

C8H10N2O — CID 135741906

IUPAC6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one
SMILESCC1Cc2nc[nH]c(=O)c2C1
InChIInChI=1S/C8H10N2O/c1-5-2-6-7(3-5)9-4-10-8(6)11/h4-5H,2-3H2,1H3,(H,9,10,11)
InChIKeySLWHTKMBPDPVBL-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.50
Rot. Bonds

About 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one

6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one (PubChem CID 135741906) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one.

Molecular Properties

Compound Name6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one
PubChem CID135741906
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one
SMILESCC1Cc2nc[nH]c(=O)c2C1
InChIInChI=1S/C8H10N2O/c1-5-2-6-7(3-5)9-4-10-8(6)11/h4-5H,2-3H2,1H3,(H,9,10,11)
InChIKeySLWHTKMBPDPVBL-UHFFFAOYSA-N
XLogP0.50
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one?
The IUPAC name of 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one (CID 135741906) is 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one.
What is the SMILES notation for 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one?
The canonical SMILES for 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one is CC1Cc2nc[nH]c(=O)c2C1.
What is the InChIKey of 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one?
The InChIKey is SLWHTKMBPDPVBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-5-2-6-7(3-5)9-4-10-8(6)11/h4-5H,2-3H2,1H3,(H,9,10,11).
What are the key properties of 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one?
6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one has a molecular weight of 150.18 g/mol, XLogP of 0.50, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one is sourced from PubChem (CID 135741906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).