2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine

C14H15FN4O — CID 137211863

IUPAC2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine
SMILESCNC1C=Cn2cc(-c3cccc(OCF)c3)nc2N1
InChIInChI=1S/C14H15FN4O/c1-16-13-5-6-19-8-12(17-14(19)18-13)10-3-2-4-11(7-10)20-9-15/h2-8,13,16H,9H2,1H3,(H,17,18)
InChIKeyWVJZICRLNJHMOJ-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.30
Rot. Bonds4

About 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine

2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine (PubChem CID 137211863) has the molecular formula C14H15FN4O and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine.

Molecular Properties

Compound Name2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine
PubChem CID137211863
Molecular FormulaC14H15FN4O
Molecular Weight274.30 g/mol
Exact Mass274.12
IUPAC Name2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine
SMILESCNC1C=Cn2cc(-c3cccc(OCF)c3)nc2N1
InChIInChI=1S/C14H15FN4O/c1-16-13-5-6-19-8-12(17-14(19)18-13)10-3-2-4-11(7-10)20-9-15/h2-8,13,16H,9H2,1H3,(H,17,18)
InChIKeyWVJZICRLNJHMOJ-UHFFFAOYSA-N
XLogP2.30
TPSA51.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine?
The IUPAC name of 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine (CID 137211863) is 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine.
What is the SMILES notation for 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine?
The canonical SMILES for 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine is CNC1C=Cn2cc(-c3cccc(OCF)c3)nc2N1.
What is the InChIKey of 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine?
The InChIKey is WVJZICRLNJHMOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4O/c1-16-13-5-6-19-8-12(17-14(19)18-13)10-3-2-4-11(7-10)20-9-15/h2-8,13,16H,9H2,1H3,(H,17,18).
What are the key properties of 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine?
2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine has a molecular weight of 274.30 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(fluoromethoxy)phenyl]-N-methyl-7,8-dihydroimidazo[1,2-a]pyrimidin-7-amine is sourced from PubChem (CID 137211863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).