7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine

C18H19FN6 — CID 142996604

IUPAC7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine
SMILESCCCc1c(Cn2ccnc2C2=NCCC=C2F)ncn2ccnc12
InChIInChI=1S/C18H19FN6/c1-2-4-13-15(23-12-25-10-8-21-17(13)25)11-24-9-7-22-18(24)16-14(19)5-3-6-20-16/h5,7-10,12H,2-4,6,11H2,1H3
InChIKeyVTFYGUJXSDOGKK-UHFFFAOYSA-N
MW338.39 g/mol
LogP2.97
Rot. Bonds5

About 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine

7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine (PubChem CID 142996604) has the molecular formula C18H19FN6 and a molecular weight of 338.39 g/mol. Its IUPAC name is 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine
PubChem CID142996604
Molecular FormulaC18H19FN6
Molecular Weight338.39 g/mol
Exact Mass338.17
IUPAC Name7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine
SMILESCCCc1c(Cn2ccnc2C2=NCCC=C2F)ncn2ccnc12
InChIInChI=1S/C18H19FN6/c1-2-4-13-15(23-12-25-10-8-21-17(13)25)11-24-9-7-22-18(24)16-14(19)5-3-6-20-16/h5,7-10,12H,2-4,6,11H2,1H3
InChIKeyVTFYGUJXSDOGKK-UHFFFAOYSA-N
XLogP2.97
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine?
The IUPAC name of 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine (CID 142996604) is 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine.
What is the SMILES notation for 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine?
The canonical SMILES for 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine is CCCc1c(Cn2ccnc2C2=NCCC=C2F)ncn2ccnc12.
What is the InChIKey of 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine?
The InChIKey is VTFYGUJXSDOGKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN6/c1-2-4-13-15(23-12-25-10-8-21-17(13)25)11-24-9-7-22-18(24)16-14(19)5-3-6-20-16/h5,7-10,12H,2-4,6,11H2,1H3.
What are the key properties of 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine?
7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine has a molecular weight of 338.39 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[[2-(5-fluoro-2,3-dihydropyridin-6-yl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine is sourced from PubChem (CID 142996604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).