4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione

C8H8N2O2 — CID 83861344

IUPAC4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione
SMILESCc1[nH]c(=O)nc2c1C(=O)CC2
InChIInChI=1S/C8H8N2O2/c1-4-7-5(2-3-6(7)11)10-8(12)9-4/h2-3H2,1H3,(H,9,10,12)
InChIKeyCWDSNFVYRVLXAN-UHFFFAOYSA-N
MW164.16 g/mol
LogP0.21
Rot. Bonds

About 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione

4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione (PubChem CID 83861344) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione.

Molecular Properties

Compound Name4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione
PubChem CID83861344
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione
SMILESCc1[nH]c(=O)nc2c1C(=O)CC2
InChIInChI=1S/C8H8N2O2/c1-4-7-5(2-3-6(7)11)10-8(12)9-4/h2-3H2,1H3,(H,9,10,12)
InChIKeyCWDSNFVYRVLXAN-UHFFFAOYSA-N
XLogP0.21
TPSA62.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione?
The IUPAC name of 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione (CID 83861344) is 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione.
What is the SMILES notation for 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione?
The canonical SMILES for 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione is Cc1[nH]c(=O)nc2c1C(=O)CC2.
What is the InChIKey of 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione?
The InChIKey is CWDSNFVYRVLXAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-4-7-5(2-3-6(7)11)10-8(12)9-4/h2-3H2,1H3,(H,9,10,12).
What are the key properties of 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione?
4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione has a molecular weight of 164.16 g/mol, XLogP of 0.21, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6,7-dihydro-3H-cyclopenta[d]pyrimidine-2,5-dione is sourced from PubChem (CID 83861344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).