5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline

C15H16FN3 — CID 71180322

IUPAC5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline
SMILESCc1cnc2c3ccc(F)cc3nc(C(C)(C)C)n12
InChIInChI=1S/C15H16FN3/c1-9-8-17-13-11-6-5-10(16)7-12(11)18-14(19(9)13)15(2,3)4/h5-8H,1-4H3
InChIKeyCJOVEQPUCWJMKY-UHFFFAOYSA-N
MW257.31 g/mol
LogP3.63
Rot. Bonds

About 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline

5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline (PubChem CID 71180322) has the molecular formula C15H16FN3 and a molecular weight of 257.31 g/mol. Its IUPAC name is 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline.

Molecular Properties

Compound Name5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline
PubChem CID71180322
Molecular FormulaC15H16FN3
Molecular Weight257.31 g/mol
Exact Mass257.13
IUPAC Name5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline
SMILESCc1cnc2c3ccc(F)cc3nc(C(C)(C)C)n12
InChIInChI=1S/C15H16FN3/c1-9-8-17-13-11-6-5-10(16)7-12(11)18-14(19(9)13)15(2,3)4/h5-8H,1-4H3
InChIKeyCJOVEQPUCWJMKY-UHFFFAOYSA-N
XLogP3.63
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline?
The IUPAC name of 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline (CID 71180322) is 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline.
What is the SMILES notation for 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline?
The canonical SMILES for 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline is Cc1cnc2c3ccc(F)cc3nc(C(C)(C)C)n12.
What is the InChIKey of 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline?
The InChIKey is CJOVEQPUCWJMKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3/c1-9-8-17-13-11-6-5-10(16)7-12(11)18-14(19(9)13)15(2,3)4/h5-8H,1-4H3.
What are the key properties of 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline?
5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline has a molecular weight of 257.31 g/mol, XLogP of 3.63, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-8-fluoro-3-methylimidazo[1,2-c]quinazoline is sourced from PubChem (CID 71180322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).