2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one

C9H10N2O — CID 83861338

IUPAC2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one
SMILESCc1nc(C)c2c(n1)CCC2=O
InChIInChI=1S/C9H10N2O/c1-5-9-7(3-4-8(9)12)11-6(2)10-5/h3-4H2,1-2H3
InChIKeyWXSDTTZCWYYYEM-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.22
Rot. Bonds

About 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one

2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one (PubChem CID 83861338) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one.

Molecular Properties

Compound Name2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one
PubChem CID83861338
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one
SMILESCc1nc(C)c2c(n1)CCC2=O
InChIInChI=1S/C9H10N2O/c1-5-9-7(3-4-8(9)12)11-6(2)10-5/h3-4H2,1-2H3
InChIKeyWXSDTTZCWYYYEM-UHFFFAOYSA-N
XLogP1.22
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4,7-trimethyl-7,8-dihydro-6H-quinazolin-5-one
CID 22948964
4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione
CID 83861344
2,4-dimethyl-5,6,7,8,9,10,11,12-octahydrocyclodeca[d]pyrimidine
CID 123799232
2,4-dimethyl-5,6,8,9-tetrahydrothiepino[4,5-d]pyrimidine;ethane
CID 177024439
5-oxo-2-propan-2-yl-6,7-dihydrocyclopenta[d]pyrimidine-4-carboxylic acid
CID 83863458
2,4,5-trimethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 22943707
2,4-dimethyl-5,7,8,9-tetrahydrothiepino[4,3-d]pyrimidine
CID 177024316
2-methyl-3-propan-2-yl-5,6-dihydrocyclopenta[c]pyrazol-4-one
CID 83906263
5-iodo-2,4,6-trimethylpyrimidine
CID 10911871
5-(4-chlorophenyl)-2,4,6-trimethylpyrimidine
CID 13046106
2-amino-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
CID 83679490
2,4-dimethyl-5,6,7,8,9,10,11,12-octahydropyrimido[5,4-e]azecine;ethane
CID 178044254

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one?
The IUPAC name of 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one (CID 83861338) is 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one.
What is the SMILES notation for 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one?
The canonical SMILES for 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one is Cc1nc(C)c2c(n1)CCC2=O.
What is the InChIKey of 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one?
The InChIKey is WXSDTTZCWYYYEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-5-9-7(3-4-8(9)12)11-6(2)10-5/h3-4H2,1-2H3.
What are the key properties of 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one?
2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one has a molecular weight of 162.19 g/mol, XLogP of 1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6,7-dihydrocyclopenta[d]pyrimidin-5-one is sourced from PubChem (CID 83861338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).