4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one

C14H14N2O2 — CID 65430258

IUPAC4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one
SMILESCC1CC1c1nc(O)c(-c2ccccc2)c(=O)[nH]1
InChIInChI=1S/C14H14N2O2/c1-8-7-10(8)12-15-13(17)11(14(18)16-12)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H2,15,16,17,18)
InChIKeyPNTPYISXJLAYRE-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.27
Rot. Bonds2

About 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one

4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one (PubChem CID 65430258) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one
PubChem CID65430258
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one
SMILESCC1CC1c1nc(O)c(-c2ccccc2)c(=O)[nH]1
InChIInChI=1S/C14H14N2O2/c1-8-7-10(8)12-15-13(17)11(14(18)16-12)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H2,15,16,17,18)
InChIKeyPNTPYISXJLAYRE-UHFFFAOYSA-N
XLogP2.27
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopentyl-4-hydroxy-5-phenyl-1H-pyrimidin-6-one
CID 65429882
4-hydroxy-5-phenyl-2-piperidin-4-yl-1H-pyrimidin-6-one
CID 65431755
2-cyclopropyl-4-hydroxy-5-(3-methylphenyl)-1H-pyrimidin-6-one
CID 79416999
4-hydroxy-2-(methylsulfonylmethyl)-5-phenyl-1H-pyrimidin-6-one
CID 65431560
5-(3-chlorophenyl)-2-(2,2-dimethylcyclopropyl)-4-hydroxy-1H-pyrimidin-6-one
CID 107925383
2-cyclobutyl-5-(4-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one
CID 79437607
5-(3-chlorophenyl)-4-hydroxy-2-(5-methyloxolan-2-yl)-1H-pyrimidin-6-one
CID 82840255
2-(4-bromophenyl)-4-hydroxy-5-phenyl-1H-pyrimidin-6-one
CID 10807290
5-(2-bromophenyl)-2-cyclopropyl-4-hydroxy-1H-pyrimidin-6-one
CID 79439110
4-hydroxy-2-[2-(2-methoxyethoxy)ethyl]-5-phenyl-1H-pyrimidin-6-one
CID 102927167
2-(1-ethoxypropyl)-4-hydroxy-5-phenyl-1H-pyrimidin-6-one
CID 116705733
2-cyclopentyl-5-(2-fluorophenyl)-4-hydroxy-1H-pyrimidin-6-one
CID 79439270

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one?
The IUPAC name of 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one (CID 65430258) is 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one is CC1CC1c1nc(O)c(-c2ccccc2)c(=O)[nH]1.
What is the InChIKey of 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one?
The InChIKey is PNTPYISXJLAYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-8-7-10(8)12-15-13(17)11(14(18)16-12)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H2,15,16,17,18).
What are the key properties of 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one?
4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one has a molecular weight of 242.28 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-(2-methylcyclopropyl)-5-phenyl-1H-pyrimidin-6-one is sourced from PubChem (CID 65430258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).