N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine

C82H84ClN17O4 — CID 158595394

About N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine

N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine (PubChem CID 158595394) has the molecular formula C82H84ClN17O4 and a molecular weight of 1407.14 g/mol. Its IUPAC name is N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine.

Molecular Properties

• Compound Name: N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine
• PubChem CID: 158595394
• Molecular Formula: C82H84ClN17O4
• Molecular Weight: 1407.14 g/mol
• Exact Mass: 1405.66
• IUPAC Name: N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine
• SMILES: Cc1cc2nc(-c3ccc4onc(C)c4c3)c(NC(C)(C)C)n2cn1.Cc1noc2ccc(-c3ccc(-c4nc5ccccn5c4NC(C)(C)C)cc3)cc12.Cc1noc2ccc(-c3nc4ccc(Cl)cn4c3NC(C)(C)C)cc12.Cc1noc2ccc(-c3nc4ccccn4c3NC(C)(C)C)cc12
• InChI: InChI=1S/C25H24N4O.C19H19ClN4O.C19H21N5O.C19H20N4O/c1-16-20-15-19(12-13-21(20)30-28-16)17-8-10-18(11-9-17)23-24(27-25(2,3)4)29-14-6-5-7-22(29)26-23;1-11-14-9-12(5-7-15(14)25-23-11)17-18(22-19(2,3)4)24-10-13(20)6-8-16(24)21-17;1-11-8-16-21-17(18(22-19(3,4)5)24(16)10-20-11)13-6-7-15-14(9-13)12(2)23-25-15;1-12-14-11-13(8-9-15(14)24-22-12)17-18(21-19(2,3)4)23-10-6-5-7-16(23)20-17/h5-15,27H,1-4H3;5-10,22H,1-4H3;6-10,22H,1-5H3;5-11,21H,1-4H3
• InChIKey: HUYRBUVBXUFKQN-UHFFFAOYSA-N
• XLogP: 20.67
• TPSA: 234.33 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 9
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1407.14
LogP ≤ 5	20.67
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine?

The IUPAC name of N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine (CID 158595394) is N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine.

What is the SMILES notation for N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine?

The canonical SMILES for N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine is Cc1cc2nc(-c3ccc4onc(C)c4c3)c(NC(C)(C)C)n2cn1.Cc1noc2ccc(-c3ccc(-c4nc5ccccn5c4NC(C)(C)C)cc3)cc12.Cc1noc2ccc(-c3nc4ccc(Cl)cn4c3NC(C)(C)C)cc12.Cc1noc2ccc(-c3nc4ccccn4c3NC(C)(C)C)cc12.

What is the InChIKey of N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine?

The InChIKey is HUYRBUVBXUFKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O.C19H19ClN4O.C19H21N5O.C19H20N4O/c1-16-20-15-19(12-13-21(20)30-28-16)17-8-10-18(11-9-17)23-24(27-25(2,3)4)29-14-6-5-7-22(29)26-23;1-11-14-9-12(5-7-15(14)25-23-11)17-18(22-19(2,3)4)24-10-13(20)6-8-16(24)21-17;1-11-8-16-21-17(18(22-19(3,4)5)24(16)10-20-11)13-6-7-15-14(9-13)12(2)23-25-15;1-12-14-11-13(8-9-15(14)24-22-12)17-18(21-19(2,3)4)23-10-6-5-7-16(23)20-17/h5-15,27H,1-4H3;5-10,22H,1-4H3;6-10,22H,1-5H3;5-11,21H,1-4H3.

What are the key properties of N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine?

N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine has a molecular weight of 1407.14 g/mol, XLogP of 20.67, 9 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-tert-butyl-6-chloro-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-2-[4-(3-methyl-1,2-benzoxazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-amine;N-tert-butyl-7-methyl-2-(3-methyl-1,2-benzoxazol-5-yl)imidazo[1,2-c]pyrimidin-3-amine is sourced from PubChem (CID 158595394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).