4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione

C10H12N2O2 — CID 83861346

IUPAC4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione
SMILESCC(C)c1nc(=O)[nH]c2c1C(=O)CC2
InChIInChI=1S/C10H12N2O2/c1-5(2)9-8-6(3-4-7(8)13)11-10(14)12-9/h5H,3-4H2,1-2H3,(H,11,12,14)
InChIKeyCDCJYWNFPQNNQO-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.02
Rot. Bonds1

About 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione

4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione (PubChem CID 83861346) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione.

Molecular Properties

Compound Name4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione
PubChem CID83861346
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione
SMILESCC(C)c1nc(=O)[nH]c2c1C(=O)CC2
InChIInChI=1S/C10H12N2O2/c1-5(2)9-8-6(3-4-7(8)13)11-10(14)12-9/h5H,3-4H2,1-2H3,(H,11,12,14)
InChIKeyCDCJYWNFPQNNQO-UHFFFAOYSA-N
XLogP1.02
TPSA62.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione?
The IUPAC name of 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione (CID 83861346) is 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione.
What is the SMILES notation for 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione?
The canonical SMILES for 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione is CC(C)c1nc(=O)[nH]c2c1C(=O)CC2.
What is the InChIKey of 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione?
The InChIKey is CDCJYWNFPQNNQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-5(2)9-8-6(3-4-7(8)13)11-10(14)12-9/h5H,3-4H2,1-2H3,(H,11,12,14).
What are the key properties of 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione?
4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione has a molecular weight of 192.22 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-6,7-dihydro-1H-cyclopenta[d]pyrimidine-2,5-dione is sourced from PubChem (CID 83861346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).