2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide

C116H119F3N28O10 — CID 159884625

About 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide

2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide (PubChem CID 159884625) has the molecular formula C116H119F3N28O10 and a molecular weight of 2122.41 g/mol. Its IUPAC name is 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide.

Molecular Properties

• Compound Name: 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide
• PubChem CID: 159884625
• Molecular Formula: C116H119F3N28O10
• Molecular Weight: 2122.41 g/mol
• Exact Mass: 2120.96
• IUPAC Name: 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide
• SMILES: COc1cc(F)cc(-c2cc(C)n3cnc(C(=O)NC(C)(C)C)c3n2)c1.COc1cccc(-c2cc(C)n3cnc(C(=O)NC(C)(C)C)c3n2)c1.Cc1cc(-c2cc(F)cc(F)c2)nc2c(C(=O)NC(C)(C)C)ncn12.Cc1cc(-c2ccc3ncoc3c2)nc2c(C(=O)N[C@@H](C)C3CC3)ncn12.Cc1cc(-c2ccc3ocnc3c2)nc2c(C(=O)N[C@@H](C)C3CC3)ncn12.Cc1cc(-c2ccn3ccnc3c2)nc2c(C(=O)N[C@@H](C)C3CC3)ncn12
• InChI: InChI=1S/C20H20N6O.2C20H19N5O2.C19H21FN4O2.C19H22N4O2.C18H18F2N4O/c1-12-9-16(15-5-7-25-8-6-21-17(25)10-15)24-19-18(22-11-26(12)19)20(27)23-13(2)14-3-4-14;1-11-7-15(14-5-6-17-16(8-14)22-10-27-17)24-19-18(21-9-25(11)19)20(26)23-12(2)13-3-4-13;1-11-7-16(14-5-6-15-17(8-14)27-10-22-15)24-19-18(21-9-25(11)19)20(26)23-12(2)13-3-4-13;1-11-6-15(12-7-13(20)9-14(8-12)26-5)22-17-16(21-10-24(11)17)18(25)23-19(2,3)4;1-12-9-15(13-7-6-8-14(10-13)25-5)21-17-16(20-11-23(12)17)18(24)22-19(2,3)4;1-10-5-14(11-6-12(19)8-13(20)7-11)22-16-15(21-9-24(10)16)17(25)23-18(2,3)4/h5-11,13-14H,3-4H2,1-2H3,(H,23,27);2*5-10,12-13H,3-4H2,1-2H3,(H,23,26);6-10H,1-5H3,(H,23,25);6-11H,1-5H3,(H,22,24);5-9H,1-4H3,(H,23,25)/t13-;2*12-;;;/m000.../s1
• InChIKey: NTYVULVVSCDNCM-MRAWBVIDSA-N
• XLogP: 19.76
• TPSA: 443.56 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 32
• Rotatable Bonds: 20
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2122.41
LogP ≤ 5	19.76
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide?

The IUPAC name of 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide (CID 159884625) is 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide.

What is the SMILES notation for 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide?

The canonical SMILES for 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide is COc1cc(F)cc(-c2cc(C)n3cnc(C(=O)NC(C)(C)C)c3n2)c1.COc1cccc(-c2cc(C)n3cnc(C(=O)NC(C)(C)C)c3n2)c1.Cc1cc(-c2cc(F)cc(F)c2)nc2c(C(=O)NC(C)(C)C)ncn12.Cc1cc(-c2ccc3ncoc3c2)nc2c(C(=O)N[C@@H](C)C3CC3)ncn12.Cc1cc(-c2ccc3ocnc3c2)nc2c(C(=O)N[C@@H](C)C3CC3)ncn12.Cc1cc(-c2ccn3ccnc3c2)nc2c(C(=O)N[C@@H](C)C3CC3)ncn12.

What is the InChIKey of 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide?

The InChIKey is NTYVULVVSCDNCM-MRAWBVIDSA-N. The full InChI is InChI=1S/C20H20N6O.2C20H19N5O2.C19H21FN4O2.C19H22N4O2.C18H18F2N4O/c1-12-9-16(15-5-7-25-8-6-21-17(25)10-15)24-19-18(22-11-26(12)19)20(27)23-13(2)14-3-4-14;1-11-7-15(14-5-6-17-16(8-14)22-10-27-17)24-19-18(21-9-25(11)19)20(26)23-12(2)13-3-4-13;1-11-7-16(14-5-6-15-17(8-14)27-10-22-15)24-19-18(21-9-25(11)19)20(26)23-12(2)13-3-4-13;1-11-6-15(12-7-13(20)9-14(8-12)26-5)22-17-16(21-10-24(11)17)18(25)23-19(2,3)4;1-12-9-15(13-7-6-8-14(10-13)25-5)21-17-16(20-11-23(12)17)18(24)22-19(2,3)4;1-10-5-14(11-6-12(19)8-13(20)7-11)22-16-15(21-9-24(10)16)17(25)23-18(2,3)4/h5-11,13-14H,3-4H2,1-2H3,(H,23,27);2*5-10,12-13H,3-4H2,1-2H3,(H,23,26);6-10H,1-5H3,(H,23,25);6-11H,1-5H3,(H,22,24);5-9H,1-4H3,(H,23,25)/t13-;2*12-;;;/m000.../s1.

What are the key properties of 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide?

2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide has a molecular weight of 2122.41 g/mol, XLogP of 19.76, 20 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;2-(1,3-benzoxazol-6-yl)-N-[(1S)-1-cyclopropylethyl]-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3,5-difluorophenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-fluoro-5-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-tert-butyl-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropylethyl]-2-imidazo[1,2-a]pyridin-7-yl-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide is sourced from PubChem (CID 159884625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).