6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione

C8H10N2O2 — CID 12512055

IUPAC6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione
SMILESCc1c(C2CC2)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C8H10N2O2/c1-4-6(5-2-3-5)9-8(12)10-7(4)11/h5H,2-3H2,1H3,(H2,9,10,11,12)
InChIKeyNDXBSMUAKABZAI-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.25
Rot. Bonds1

About 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione

6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione (PubChem CID 12512055) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione
PubChem CID12512055
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione
SMILESCc1c(C2CC2)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C8H10N2O2/c1-4-6(5-2-3-5)9-8(12)10-7(4)11/h5H,2-3H2,1H3,(H2,9,10,11,12)
InChIKeyNDXBSMUAKABZAI-UHFFFAOYSA-N
XLogP0.25
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione (CID 12512055) is 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione is Cc1c(C2CC2)[nH]c(=O)[nH]c1=O.
What is the InChIKey of 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione?
The InChIKey is NDXBSMUAKABZAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-4-6(5-2-3-5)9-8(12)10-7(4)11/h5H,2-3H2,1H3,(H2,9,10,11,12).
What are the key properties of 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione?
6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione has a molecular weight of 166.18 g/mol, XLogP of 0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-5-methyl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 12512055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).