7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one

C11H10FN5O2 — CID 167629859

IUPAC7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one
SMILESC=C1CN(c2c(F)nc3n(C)ccn3c2=O)C(=O)N1
InChIInChI=1S/C11H10FN5O2/c1-6-5-17(11(19)13-6)7-8(12)14-10-15(2)3-4-16(10)9(7)18/h3-4H,1,5H2,2H3,(H,13,19)
InChIKeyCDMRFXDRAVSROG-UHFFFAOYSA-N
MW263.23 g/mol
LogP0.22
Rot. Bonds1

About 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one

7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one (PubChem CID 167629859) has the molecular formula C11H10FN5O2 and a molecular weight of 263.23 g/mol. Its IUPAC name is 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one
PubChem CID167629859
Molecular FormulaC11H10FN5O2
Molecular Weight263.23 g/mol
Exact Mass263.08
IUPAC Name7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one
SMILESC=C1CN(c2c(F)nc3n(C)ccn3c2=O)C(=O)N1
InChIInChI=1S/C11H10FN5O2/c1-6-5-17(11(19)13-6)7-8(12)14-10-15(2)3-4-16(10)9(7)18/h3-4H,1,5H2,2H3,(H,13,19)
InChIKeyCDMRFXDRAVSROG-UHFFFAOYSA-N
XLogP0.22
TPSA71.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.23
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one with MolForge

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Related Compounds

5,5-Dimethyl-3-[3-(5-methyl-7-oxoimidazo[1,2-a]pyrimidin-1-yl)propyl]imidazolidine-2,4-dione
CID 136562254
N-[6,8-dioxo-7-(3,3,3-trifluoropropyl)-1,9-dihydropurin-2-yl]acetamide
CID 156391992
N-[6,8-dioxo-7-(2,2,2-trifluoroethyl)-1,9-dihydropurin-2-yl]acetamide
CID 156392440
N-[9-methyl-6,8-dioxo-7-(3,3,3-trifluoropropyl)-1H-purin-2-yl]acetamide
CID 156435327
N-[6,8-dioxo-7-(1,2,2-trifluoroethyl)-1,9-dihydropurin-2-yl]acetamide
CID 175363975
N-[6,8-dioxo-7-(2,3,3-trifluoropropyl)-1,9-dihydropurin-2-yl]acetamide
CID 175363982
1,3-Dimethyl-dihydroimidazo-[1,2-a]-purine-dione
CID 145706325
3,7-Dimethyl-7-prop-2-enylpurin-7-ium-2,6-dione
CID 18961907
2-Amino-7-prop-2-enyl-1,9-dihydropurine-6,8-dione
CID 136341978
2-amino-9-methyl-7-prop-2-enyl-1H-purine-6,8-dione
CID 137179099
N-(6,8-dioxo-7-prop-2-enyl-1,9-dihydropurin-2-yl)acetamide
CID 153282985
2-amino-9-propan-2-yl-7-prop-2-enyl-1H-purine-6,8-dione
CID 153411211

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one (CID 167629859) is 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one is C=C1CN(c2c(F)nc3n(C)ccn3c2=O)C(=O)N1.
What is the InChIKey of 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one?
The InChIKey is CDMRFXDRAVSROG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN5O2/c1-6-5-17(11(19)13-6)7-8(12)14-10-15(2)3-4-16(10)9(7)18/h3-4H,1,5H2,2H3,(H,13,19).
What are the key properties of 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one?
7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one has a molecular weight of 263.23 g/mol, XLogP of 0.22, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-1-methyl-6-(4-methylidene-2-oxoimidazolidin-1-yl)imidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 167629859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).