2-cyclopropyl-5-methyl-1H-pyrimidin-6-one

C8H10N2O — CID 23465437

IUPAC2-cyclopropyl-5-methyl-1H-pyrimidin-6-one
SMILESCc1cnc(C2CC2)[nH]c1=O
InChIInChI=1S/C8H10N2O/c1-5-4-9-7(6-2-3-6)10-8(5)11/h4,6H,2-3H2,1H3,(H,9,10,11)
InChIKeySMRHVBWCPQJUEV-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.96
Rot. Bonds1

About 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one

2-cyclopropyl-5-methyl-1H-pyrimidin-6-one (PubChem CID 23465437) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopropyl-5-methyl-1H-pyrimidin-6-one
PubChem CID23465437
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name2-cyclopropyl-5-methyl-1H-pyrimidin-6-one
SMILESCc1cnc(C2CC2)[nH]c1=O
InChIInChI=1S/C8H10N2O/c1-5-4-9-7(6-2-3-6)10-8(5)11/h4,6H,2-3H2,1H3,(H,9,10,11)
InChIKeySMRHVBWCPQJUEV-UHFFFAOYSA-N
XLogP0.96
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one (CID 23465437) is 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one is Cc1cnc(C2CC2)[nH]c1=O.
What is the InChIKey of 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one?
The InChIKey is SMRHVBWCPQJUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-5-4-9-7(6-2-3-6)10-8(5)11/h4,6H,2-3H2,1H3,(H,9,10,11).
What are the key properties of 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one?
2-cyclopropyl-5-methyl-1H-pyrimidin-6-one has a molecular weight of 150.18 g/mol, XLogP of 0.96, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 23465437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).