4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine

C163H188F3N21 — CID 159726785

IUPAC4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine
SMILESCC(C)(C)c1cc2cccnc2nc1C(F)(F)F.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1ccc2cccnc2c1.CC(C)(C)c1ccc2ncccc2c1.CC(C)(C)c1cccc2cccnc12.CC(C)(C)c1ccnc2ccncc12.CC(C)(C)c1ccnc2cnccc12.CC(C)(C)c1ccnc2ncccc12.CC(C)(C)c1cnc2ccccc2c1.CC(C)(C)c1cnc2ncccc2c1.CC(C)(C)c1nccc2ncccc12.CC(C)(C)c1ncnc2ccccc12.Cc1ccc2ncnc(C(C)(C)C)c2c1
InChIInChI=1S/C13H13F3N2.C13H16N2.5C13H15N.6C12H14N2/c1-12(2,3)9-7-8-5-4-6-17-11(8)18-10(9)13(14,15)16;1-9-5-6-11-10(7-9)12(13(2,3)4)15-8-14-11;1-13(2,3)11-8-4-6-10-7-5-9-14-12(10)11;1-13(2,3)11-6-7-12-10(9-11)5-4-8-14-12;1-13(2,3)11-7-6-10-5-4-8-14-12(10)9-11;1-13(2,3)11-8-10-6-4-5-7-12(10)14-9-11;1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-12(2,3)10-4-7-14-11-5-6-13-8-9(10)11;1-12(2,3)10-5-7-14-11-8-13-6-4-9(10)11;1-12(2,3)11-9-5-4-7-13-10(9)6-8-14-11;1-12(2,3)10-6-8-14-11-9(10)5-4-7-13-11;1-12(2,3)10-7-9-5-4-6-13-11(9)14-8-10;1-12(2,3)11-9-6-4-5-7-10(9)13-8-14-11/h4-7H,1-3H3;5-8H,1-4H3;5*4-9H,1-3H3;6*4-8H,1-3H3
InChIKeyNASSDZUPVHHLRJ-UHFFFAOYSA-N
MW2498.44 g/mol
LogP42.41
Rot. Bonds

About 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine

4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine (PubChem CID 159726785) has the molecular formula C163H188F3N21 and a molecular weight of 2498.44 g/mol. Its IUPAC name is 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine.

Molecular Properties

Compound Name4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine
PubChem CID159726785
Molecular FormulaC163H188F3N21
Molecular Weight2498.44 g/mol
Exact Mass2496.53
IUPAC Name4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine
SMILESCC(C)(C)c1cc2cccnc2nc1C(F)(F)F.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1ccc2cccnc2c1.CC(C)(C)c1ccc2ncccc2c1.CC(C)(C)c1cccc2cccnc12.CC(C)(C)c1ccnc2ccncc12.CC(C)(C)c1ccnc2cnccc12.CC(C)(C)c1ccnc2ncccc12.CC(C)(C)c1cnc2ccccc2c1.CC(C)(C)c1cnc2ncccc2c1.CC(C)(C)c1nccc2ncccc12.CC(C)(C)c1ncnc2ccccc12.Cc1ccc2ncnc(C(C)(C)C)c2c1
InChIInChI=1S/C13H13F3N2.C13H16N2.5C13H15N.6C12H14N2/c1-12(2,3)9-7-8-5-4-6-17-11(8)18-10(9)13(14,15)16;1-9-5-6-11-10(7-9)12(13(2,3)4)15-8-14-11;1-13(2,3)11-8-4-6-10-7-5-9-14-12(10)11;1-13(2,3)11-6-7-12-10(9-11)5-4-8-14-12;1-13(2,3)11-7-6-10-5-4-8-14-12(10)9-11;1-13(2,3)11-8-10-6-4-5-7-12(10)14-9-11;1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-12(2,3)10-4-7-14-11-5-6-13-8-9(10)11;1-12(2,3)10-5-7-14-11-8-13-6-4-9(10)11;1-12(2,3)11-9-5-4-7-13-10(9)6-8-14-11;1-12(2,3)10-6-8-14-11-9(10)5-4-7-13-11;1-12(2,3)10-7-9-5-4-6-13-11(9)14-8-10;1-12(2,3)11-9-6-4-5-7-10(9)13-8-14-11/h4-7H,1-3H3;5-8H,1-4H3;5*4-9H,1-3H3;6*4-8H,1-3H3
InChIKeyNASSDZUPVHHLRJ-UHFFFAOYSA-N
XLogP42.41
TPSA270.69 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds
Heavy Atoms187
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002498.44
LogP ≤ 542.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine?
The IUPAC name of 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine (CID 159726785) is 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine.
What is the SMILES notation for 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine?
The canonical SMILES for 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine is CC(C)(C)c1cc2cccnc2nc1C(F)(F)F.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1ccc2cccnc2c1.CC(C)(C)c1ccc2ncccc2c1.CC(C)(C)c1cccc2cccnc12.CC(C)(C)c1ccnc2ccncc12.CC(C)(C)c1ccnc2cnccc12.CC(C)(C)c1ccnc2ncccc12.CC(C)(C)c1cnc2ccccc2c1.CC(C)(C)c1cnc2ncccc2c1.CC(C)(C)c1nccc2ncccc12.CC(C)(C)c1ncnc2ccccc12.Cc1ccc2ncnc(C(C)(C)C)c2c1.
What is the InChIKey of 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine?
The InChIKey is NASSDZUPVHHLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F3N2.C13H16N2.5C13H15N.6C12H14N2/c1-12(2,3)9-7-8-5-4-6-17-11(8)18-10(9)13(14,15)16;1-9-5-6-11-10(7-9)12(13(2,3)4)15-8-14-11;1-13(2,3)11-8-4-6-10-7-5-9-14-12(10)11;1-13(2,3)11-6-7-12-10(9-11)5-4-8-14-12;1-13(2,3)11-7-6-10-5-4-8-14-12(10)9-11;1-13(2,3)11-8-10-6-4-5-7-12(10)14-9-11;1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-12(2,3)10-4-7-14-11-5-6-13-8-9(10)11;1-12(2,3)10-5-7-14-11-8-13-6-4-9(10)11;1-12(2,3)11-9-5-4-7-13-10(9)6-8-14-11;1-12(2,3)10-6-8-14-11-9(10)5-4-7-13-11;1-12(2,3)10-7-9-5-4-6-13-11(9)14-8-10;1-12(2,3)11-9-6-4-5-7-10(9)13-8-14-11/h4-7H,1-3H3;5-8H,1-4H3;5*4-9H,1-3H3;6*4-8H,1-3H3.
What are the key properties of 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine?
4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine has a molecular weight of 2498.44 g/mol, XLogP of 42.41, 0 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-6-methylquinazoline;3-tert-butyl-1,8-naphthyridine;4-tert-butyl-1,6-naphthyridine;4-tert-butyl-1,7-naphthyridine;4-tert-butyl-1,8-naphthyridine;5-tert-butyl-1,6-naphthyridine;4-tert-butylquinazoline;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;7-tert-butylquinoline;8-tert-butylquinoline;3-tert-butyl-2-(trifluoromethyl)-1,8-naphthyridine is sourced from PubChem (CID 159726785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).