2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide

C145H136F21N39O14S2 — CID 160774199

IUPAC2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide
SMILESCOc1cccc(-c2cc(C)n3cnc(C(=O)N[C@@H](C4CC4)C(F)(F)F)c3n2)n1.COc1cccc(-c2cc(C)n3cnc(C(=O)N[C@H](C)C4CC4)c3n2)c1.COc1cccc(-c2cc(C)n3cnc(C(=O)N[C@H](C4CC4)C(F)(F)F)c3n2)n1.Cc1cc(-c2cccc(OC(F)(F)F)n2)nc2c(C(=O)N[C@H](C)C3CC3)ncn12.Cc1cc(-c2ccns2)nc2c(C(=O)N[C@@H](C3CC3)C(F)(F)F)ncn12.Cc1cc(-c2ccns2)nc2c(C(=O)N[C@H](C3CC3)C(F)(F)F)ncn12.Cc1cc(-c2ccon2)nc2c(C(=O)NC(C3CC3)C(F)(F)F)ncn12.Cc1cc(NC(=O)c2ccccc2)nc2c(C(=O)NC(C3CC3)C(F)(F)F)ncn12
InChIInChI=1S/C20H18F3N5O2.C20H22N4O2.3C19H18F3N5O2.C16H14F3N5O2.2C16H14F3N5OS/c1-11-9-14(26-18(29)13-5-3-2-4-6-13)25-17-15(24-10-28(11)17)19(30)27-16(12-7-8-12)20(21,22)23;1-12-9-17(15-5-4-6-16(10-15)26-3)23-19-18(21-11-24(12)19)20(25)22-13(2)14-7-8-14;2*1-10-8-13(12-4-3-5-14(24-12)29-2)25-17-15(23-9-27(10)17)18(28)26-16(11-6-7-11)19(20,21)22;1-10-8-14(13-4-3-5-15(25-13)29-19(20,21)22)26-17-16(23-9-27(10)17)18(28)24-11(2)12-6-7-12;1-8-6-11(10-4-5-26-23-10)21-14-12(20-7-24(8)14)15(25)22-13(9-2-3-9)16(17,18)19;2*1-8-6-10(11-4-5-21-26-11)22-14-12(20-7-24(8)14)15(25)23-13(9-2-3-9)16(17,18)19/h2-6,9-10,12,16H,7-8H2,1H3,(H,27,30)(H,25,26,29);4-6,9-11,13-14H,7-8H2,1-3H3,(H,22,25);2*3-5,8-9,11,16H,6-7H2,1-2H3,(H,26,28);3-5,8-9,11-12H,6-7H2,1-2H3,(H,24,28);4-7,9,13H,2-3H2,1H3,(H,22,25);2*4-7,9,13H,2-3H2,1H3,(H,23,25)/t;13-;2*16-;11-;;2*13-/m.1101.10/s1
InChIKeyRZSMHESVUGXHBA-LPESSJSJSA-N
MW3112.03 g/mol
LogP25.71
Rot. Bonds37

About 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide

2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide (PubChem CID 160774199) has the molecular formula C145H136F21N39O14S2 and a molecular weight of 3112.03 g/mol. Its IUPAC name is 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide.

Molecular Properties

Compound Name2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide
PubChem CID160774199
Molecular FormulaC145H136F21N39O14S2
Molecular Weight3112.03 g/mol
Exact Mass3110.02
IUPAC Name2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide
SMILESCOc1cccc(-c2cc(C)n3cnc(C(=O)N[C@@H](C4CC4)C(F)(F)F)c3n2)n1.COc1cccc(-c2cc(C)n3cnc(C(=O)N[C@H](C)C4CC4)c3n2)c1.COc1cccc(-c2cc(C)n3cnc(C(=O)N[C@H](C4CC4)C(F)(F)F)c3n2)n1.Cc1cc(-c2cccc(OC(F)(F)F)n2)nc2c(C(=O)N[C@H](C)C3CC3)ncn12.Cc1cc(-c2ccns2)nc2c(C(=O)N[C@@H](C3CC3)C(F)(F)F)ncn12.Cc1cc(-c2ccns2)nc2c(C(=O)N[C@H](C3CC3)C(F)(F)F)ncn12.Cc1cc(-c2ccon2)nc2c(C(=O)NC(C3CC3)C(F)(F)F)ncn12.Cc1cc(NC(=O)c2ccccc2)nc2c(C(=O)NC(C3CC3)C(F)(F)F)ncn12
InChIInChI=1S/C20H18F3N5O2.C20H22N4O2.3C19H18F3N5O2.C16H14F3N5O2.2C16H14F3N5OS/c1-11-9-14(26-18(29)13-5-3-2-4-6-13)25-17-15(24-10-28(11)17)19(30)27-16(12-7-8-12)20(21,22)23;1-12-9-17(15-5-4-6-16(10-15)26-3)23-19-18(21-11-24(12)19)20(25)22-13(2)14-7-8-14;2*1-10-8-13(12-4-3-5-14(24-12)29-2)25-17-15(23-9-27(10)17)18(28)26-16(11-6-7-11)19(20,21)22;1-10-8-14(13-4-3-5-15(25-13)29-19(20,21)22)26-17-16(23-9-27(10)17)18(28)24-11(2)12-6-7-12;1-8-6-11(10-4-5-26-23-10)21-14-12(20-7-24(8)14)15(25)22-13(9-2-3-9)16(17,18)19;2*1-8-6-10(11-4-5-21-26-11)22-14-12(20-7-24(8)14)15(25)23-13(9-2-3-9)16(17,18)19/h2-6,9-10,12,16H,7-8H2,1H3,(H,27,30)(H,25,26,29);4-6,9-11,13-14H,7-8H2,1-3H3,(H,22,25);2*3-5,8-9,11,16H,6-7H2,1-2H3,(H,26,28);3-5,8-9,11-12H,6-7H2,1-2H3,(H,24,28);4-7,9,13H,2-3H2,1H3,(H,22,25);2*4-7,9,13H,2-3H2,1H3,(H,23,25)/t;13-;2*16-;11-;;2*13-/m.1101.10/s1
InChIKeyRZSMHESVUGXHBA-LPESSJSJSA-N
XLogP25.71
TPSA630.82 Ų
H-Bond Donors9
H-Bond Acceptors46
Rotatable Bonds37
Heavy Atoms221
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003112.03
LogP ≤ 525.71
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1046

Analyze 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
The IUPAC name of 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide (CID 160774199) is 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide.
What is the SMILES notation for 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
The canonical SMILES for 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide is COc1cccc(-c2cc(C)n3cnc(C(=O)N[C@@H](C4CC4)C(F)(F)F)c3n2)n1.COc1cccc(-c2cc(C)n3cnc(C(=O)N[C@H](C)C4CC4)c3n2)c1.COc1cccc(-c2cc(C)n3cnc(C(=O)N[C@H](C4CC4)C(F)(F)F)c3n2)n1.Cc1cc(-c2cccc(OC(F)(F)F)n2)nc2c(C(=O)N[C@H](C)C3CC3)ncn12.Cc1cc(-c2ccns2)nc2c(C(=O)N[C@@H](C3CC3)C(F)(F)F)ncn12.Cc1cc(-c2ccns2)nc2c(C(=O)N[C@H](C3CC3)C(F)(F)F)ncn12.Cc1cc(-c2ccon2)nc2c(C(=O)NC(C3CC3)C(F)(F)F)ncn12.Cc1cc(NC(=O)c2ccccc2)nc2c(C(=O)NC(C3CC3)C(F)(F)F)ncn12.
What is the InChIKey of 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
The InChIKey is RZSMHESVUGXHBA-LPESSJSJSA-N. The full InChI is InChI=1S/C20H18F3N5O2.C20H22N4O2.3C19H18F3N5O2.C16H14F3N5O2.2C16H14F3N5OS/c1-11-9-14(26-18(29)13-5-3-2-4-6-13)25-17-15(24-10-28(11)17)19(30)27-16(12-7-8-12)20(21,22)23;1-12-9-17(15-5-4-6-16(10-15)26-3)23-19-18(21-11-24(12)19)20(25)22-13(2)14-7-8-14;2*1-10-8-13(12-4-3-5-14(24-12)29-2)25-17-15(23-9-27(10)17)18(28)26-16(11-6-7-11)19(20,21)22;1-10-8-14(13-4-3-5-15(25-13)29-19(20,21)22)26-17-16(23-9-27(10)17)18(28)24-11(2)12-6-7-12;1-8-6-11(10-4-5-26-23-10)21-14-12(20-7-24(8)14)15(25)22-13(9-2-3-9)16(17,18)19;2*1-8-6-10(11-4-5-21-26-11)22-14-12(20-7-24(8)14)15(25)23-13(9-2-3-9)16(17,18)19/h2-6,9-10,12,16H,7-8H2,1H3,(H,27,30)(H,25,26,29);4-6,9-11,13-14H,7-8H2,1-3H3,(H,22,25);2*3-5,8-9,11,16H,6-7H2,1-2H3,(H,26,28);3-5,8-9,11-12H,6-7H2,1-2H3,(H,24,28);4-7,9,13H,2-3H2,1H3,(H,22,25);2*4-7,9,13H,2-3H2,1H3,(H,23,25)/t;13-;2*16-;11-;;2*13-/m.1101.10/s1.
What are the key properties of 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide?
2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide has a molecular weight of 3112.03 g/mol, XLogP of 25.71, 37 rotatable bonds, 9 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-2-(3-methoxyphenyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropylethyl]-4-methyl-2-[6-(trifluoromethoxy)-2-pyridinyl]imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-2-(6-methoxy-2-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-methyl-2-(1,2-oxazol-3-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-methyl-2-(1,2-thiazol-5-yl)imidazo[1,5-a]pyrimidine-8-carboxamide is sourced from PubChem (CID 160774199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).