(2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one

C15H16FN3O2 — CID 90308230

IUPAC(2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one
SMILESC[C@@H]1CCn2c(cc(OCc3ccc(F)cc3)nc2=O)N1
InChIInChI=1S/C15H16FN3O2/c1-10-6-7-19-13(17-10)8-14(18-15(19)20)21-9-11-2-4-12(16)5-3-11/h2-5,8,10,17H,6-7,9H2,1H3/t10-/m1/s1
InChIKeyBZVILSRNMJHXMK-SNVBAGLBSA-N
MW289.31 g/mol
LogP2.17
Rot. Bonds3

About (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one

(2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one (PubChem CID 90308230) has the molecular formula C15H16FN3O2 and a molecular weight of 289.31 g/mol. Its IUPAC name is (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one.

Molecular Properties

Compound Name(2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one
PubChem CID90308230
Molecular FormulaC15H16FN3O2
Molecular Weight289.31 g/mol
Exact Mass289.12
IUPAC Name(2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one
SMILESC[C@@H]1CCn2c(cc(OCc3ccc(F)cc3)nc2=O)N1
InChIInChI=1S/C15H16FN3O2/c1-10-6-7-19-13(17-10)8-14(18-15(19)20)21-9-11-2-4-12(16)5-3-11/h2-5,8,10,17H,6-7,9H2,1H3/t10-/m1/s1
InChIKeyBZVILSRNMJHXMK-SNVBAGLBSA-N
XLogP2.17
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one with MolForge

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Related Compounds

(2S)-7-[[3,5-difluoro-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methoxy]-2-methyl-2,3-dihydro-1H-imidazo[1,2-c]pyrimidin-5-one
CID 118685737
(2S)-7-[[3-fluoro-4-[[2-(trifluoromethyl)-4-pyridinyl]oxy]phenyl]methoxy]-2-methyl-2,3-dihydro-1H-imidazo[1,2-c]pyrimidin-5-one
CID 86728413
4-[(4-fluorophenyl)methoxy]-1,5,7-triazatricyclo[7.4.0.02,7]trideca-2,4-dien-6-one;2,2,2-trifluoroacetic acid
CID 130226992
7-[[3,5-difluoro-4-(4-fluoro-6-methylcyclohexa-1,3-dien-1-yl)oxyphenyl]methoxy]-2,3-dihydro-1H-imidazo[1,2-c]pyrimidin-5-one
CID 123688256
3-fluoro-5-[[(2S)-2-methyl-5-oxo-2,3-dihydro-1H-imidazo[1,2-c]pyrimidin-7-yl]oxymethyl]-2-[(2-methyl-4-pyridinyl)oxy]benzonitrile
CID 118679562
7-[[3-fluoro-4-(4-fluorophenoxy)phenyl]methoxy]-1-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-5-one
CID 71240969
(2S)-7-[(3,4-difluorophenyl)methoxy]-1,2-dimethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-5-one
CID 86728343
(2R)-8-[[4-(3,4-difluorophenoxy)-3,5-difluorophenyl]methoxy]-1,2-dimethyl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one
CID 90304105
8-[dideuterio-(3,5-difluorophenyl)methoxy]-1,2-dimethyl-3,4-dihydro-2H-pyrimido[1,2-c]pyrimidin-6-one
CID 90304062
7-[[3-fluoro-4-(6-fluoro-7-methylocta-3,5,7-trien-4-yl)oxyphenyl]methoxy]-2,3-dihydro-1H-imidazo[1,2-c]pyrimidin-5-one
CID 123890259
(9R)-4-[(3,5-difluorophenyl)methoxy]-1,5,7-triazatricyclo[7.4.0.02,7]trideca-2,4-dien-6-one
CID 118686240
7-[[3-fluoro-4-[4-fluoro-3-(trifluoromethyl)phenoxy]phenyl]methoxy]-2,3-dihydro-1H-imidazo[1,2-c]pyrimidin-5-one
CID 71243771

Frequently Asked Questions

What is the IUPAC name of (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one?
The IUPAC name of (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one (CID 90308230) is (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one.
What is the SMILES notation for (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one?
The canonical SMILES for (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one is C[C@@H]1CCn2c(cc(OCc3ccc(F)cc3)nc2=O)N1.
What is the InChIKey of (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one?
The InChIKey is BZVILSRNMJHXMK-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H16FN3O2/c1-10-6-7-19-13(17-10)8-14(18-15(19)20)21-9-11-2-4-12(16)5-3-11/h2-5,8,10,17H,6-7,9H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one?
(2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one has a molecular weight of 289.31 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-8-[(4-fluorophenyl)methoxy]-2-methyl-1,2,3,4-tetrahydropyrimido[1,2-c]pyrimidin-6-one is sourced from PubChem (CID 90308230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).