2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one

C15H18N2O4 — CID 63611623

IUPAC2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
SMILESCOc1ccc(-c2nc(O)c(C(C)C)c(=O)[nH]2)c(OC)c1
InChIInChI=1S/C15H18N2O4/c1-8(2)12-14(18)16-13(17-15(12)19)10-6-5-9(20-3)7-11(10)21-4/h5-8H,1-4H3,(H2,16,17,18,19)
InChIKeyPWZSMOBGXCJCSF-UHFFFAOYSA-N
MW290.32 g/mol
LogP2.28
Rot. Bonds4

About 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one

2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one (PubChem CID 63611623) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
PubChem CID63611623
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
SMILESCOc1ccc(-c2nc(O)c(C(C)C)c(=O)[nH]2)c(OC)c1
InChIInChI=1S/C15H18N2O4/c1-8(2)12-14(18)16-13(17-15(12)19)10-6-5-9(20-3)7-11(10)21-4/h5-8H,1-4H3,(H2,16,17,18,19)
InChIKeyPWZSMOBGXCJCSF-UHFFFAOYSA-N
XLogP2.28
TPSA84.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methoxy-4-methylphenyl)-4-methyl-5-propan-2-yl-1H-pyrimidin-6-one
CID 136696949
2-(2,5-dimethylphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
CID 63613309
2-(2-bromo-4-fluorophenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
CID 107281016
4-amino-2-(2,4-dimethoxyphenyl)-5-nitroso-1H-pyrimidin-6-one
CID 152778061
5-bromo-2-(4-chloro-2-methoxyphenyl)-4-hydroxy-1H-pyrimidin-6-one
CID 106819074
2-(2,4-dimethoxyphenyl)-5-methyl-1H-imidazole-4-carboxylic acid
CID 63362576
2-(2,4-dimethoxyphenyl)-5-methyl-1H-imidazole-4-carbaldehyde
CID 82295070
4-hydroxy-2-(3-methylphenyl)-5-propan-2-yl-1H-pyrimidin-6-one
CID 55217017
4-hydroxy-2-(2-nitrophenyl)-5-propan-2-yl-1H-pyrimidin-6-one
CID 63613808
2-(4-fluoro-3-methylphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
CID 55216829
4-hydroxy-2,5-bis(4-methoxyphenyl)-1H-pyrimidin-6-one
CID 165345881
2-(3-bromo-4-chlorophenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
CID 115565726

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one (CID 63611623) is 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one is COc1ccc(-c2nc(O)c(C(C)C)c(=O)[nH]2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one?
The InChIKey is PWZSMOBGXCJCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-8(2)12-14(18)16-13(17-15(12)19)10-6-5-9(20-3)7-11(10)21-4/h5-8H,1-4H3,(H2,16,17,18,19).
What are the key properties of 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one?
2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one has a molecular weight of 290.32 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 63611623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).