N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide

C127H147N33O9 — CID 159707318

IUPACN-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide
SMILESCOCc1nc(C)n2ccc(C(=O)NC(C)(C)C3CC3)c2n1.Cc1nc(-c2ccccn2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2cccnc2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2cccnc2)nc2c(C(=O)NC(C)C3CC3)ccn12.Cc1nc(-c2ccncc2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2ccncc2)nc2c(C(=O)NC(C)C3CC3)ccn12.Cc1nc(COC2CC2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12
InChIInChI=1S/3C19H21N5O.2C18H19N5O.C18H24N4O2.C16H22N4O2/c1-12-21-16(13-6-9-20-10-7-13)22-17-15(8-11-24(12)17)18(25)23-19(2,3)14-4-5-14;1-12-21-16(13-5-4-9-20-11-13)22-17-15(8-10-24(12)17)18(25)23-19(2,3)14-6-7-14;1-12-21-16(15-6-4-5-10-20-15)22-17-14(9-11-24(12)17)18(25)23-19(2,3)13-7-8-13;1-11(13-3-4-13)20-18(24)15-7-10-23-12(2)21-16(22-17(15)23)14-5-8-19-9-6-14;1-11(13-5-6-13)20-18(24)15-7-9-23-12(2)21-16(22-17(15)23)14-4-3-8-19-10-14;1-11-19-15(10-24-13-6-7-13)20-16-14(8-9-22(11)16)17(23)21-18(2,3)12-4-5-12;1-10-17-13(9-22-4)18-14-12(7-8-20(10)14)15(21)19-16(2,3)11-5-6-11/h6-11,14H,4-5H2,1-3H3,(H,23,25);4-5,8-11,14H,6-7H2,1-3H3,(H,23,25);4-6,9-11,13H,7-8H2,1-3H3,(H,23,25);5-11,13H,3-4H2,1-2H3,(H,20,24);3-4,7-11,13H,5-6H2,1-2H3,(H,20,24);8-9,12-13H,4-7,10H2,1-3H3,(H,21,23);7-8,11H,5-6,9H2,1-4H3,(H,19,21)
InChIKeyMYJNHMKEOKURPS-UHFFFAOYSA-N
MW2279.79 g/mol
LogP19.05
Rot. Bonds31

About N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide

N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide (PubChem CID 159707318) has the molecular formula C127H147N33O9 and a molecular weight of 2279.79 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide
PubChem CID159707318
Molecular FormulaC127H147N33O9
Molecular Weight2279.79 g/mol
Exact Mass2278.21
IUPAC NameN-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide
SMILESCOCc1nc(C)n2ccc(C(=O)NC(C)(C)C3CC3)c2n1.Cc1nc(-c2ccccn2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2cccnc2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2cccnc2)nc2c(C(=O)NC(C)C3CC3)ccn12.Cc1nc(-c2ccncc2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2ccncc2)nc2c(C(=O)NC(C)C3CC3)ccn12.Cc1nc(COC2CC2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12
InChIInChI=1S/3C19H21N5O.2C18H19N5O.C18H24N4O2.C16H22N4O2/c1-12-21-16(13-6-9-20-10-7-13)22-17-15(8-11-24(12)17)18(25)23-19(2,3)14-4-5-14;1-12-21-16(13-5-4-9-20-11-13)22-17-15(8-10-24(12)17)18(25)23-19(2,3)14-6-7-14;1-12-21-16(15-6-4-5-10-20-15)22-17-14(9-11-24(12)17)18(25)23-19(2,3)13-7-8-13;1-11(13-3-4-13)20-18(24)15-7-10-23-12(2)21-16(22-17(15)23)14-5-8-19-9-6-14;1-11(13-5-6-13)20-18(24)15-7-9-23-12(2)21-16(22-17(15)23)14-4-3-8-19-10-14;1-11-19-15(10-24-13-6-7-13)20-16-14(8-9-22(11)16)17(23)21-18(2,3)12-4-5-12;1-10-17-13(9-22-4)18-14-12(7-8-20(10)14)15(21)19-16(2,3)11-5-6-11/h6-11,14H,4-5H2,1-3H3,(H,23,25);4-5,8-11,14H,6-7H2,1-3H3,(H,23,25);4-6,9-11,13H,7-8H2,1-3H3,(H,23,25);5-11,13H,3-4H2,1-2H3,(H,20,24);3-4,7-11,13H,5-6H2,1-2H3,(H,20,24);8-9,12-13H,4-7,10H2,1-3H3,(H,21,23);7-8,11H,5-6,9H2,1-4H3,(H,19,21)
InChIKeyMYJNHMKEOKURPS-UHFFFAOYSA-N
XLogP19.05
TPSA497.94 Ų
H-Bond Donors7
H-Bond Acceptors35
Rotatable Bonds31
Heavy Atoms169
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002279.79
LogP ≤ 519.05
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1035

Analyze N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide with MolForge

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Related Compounds

7-((5-(2-(2-(dimethylami-no)propan-2-yl)morpholino)pyridin-2-yl)amino)-4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-4-yl)-2,3-dihydro-1H-pyrrolo(3,4-cIpyridin-1-one
CID 156164066
[2-[6-[(3aS,7aR)-6-[2-[4-ethenyl-5-(methylideneamino)-1-(2,2,2-trifluoroethyl)pyrrol-2-yl]-3-methylimidazo[4,5-b]pyridine-6-carbonyl]-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-2-yl]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]-(1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl)methanone
CID 129235992
[(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[5-[6-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridine-6-carbonyl]-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-2-yl]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridin-6-yl]methanone
CID 129236564
1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridin-6-yl]methanone;[(3R,4R)-4-(2-aminoethyl)-3-methylpiperidin-1-yl]-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridin-6-yl]methanone
CID 145330064
1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridin-6-yl]methanone;[(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridin-6-yl]methanone
CID 145330077
[2-[5-[(3aS,7aR)-6-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridine-6-carbonyl]-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-2-yl]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]-(1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl)methanone
CID 155131871
[(3R)-3-aminopiperidin-1-yl]-[2-[5-[[(3R)-1-[2-[1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-3-(2,2-difluoroethyl)imidazo[4,5-b]pyridine-6-carbonyl]piperidin-3-yl]amino]-1-(2,2-difluoropropyl)pyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]methanone
CID 155131890
[(3aS,7aS)-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl]-[2-[5-[[(3R)-1-[2-[1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-3-ethylimidazo[4,5-b]pyridine-6-carbonyl]piperidin-3-yl]amino]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]methanone
CID 155131917
[(3R)-3-aminopiperidin-1-yl]-[3-methyl-2-[6-[6-[3-methyl-2-[1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridine-6-carbonyl]-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-2-yl]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]imidazo[4,5-b]pyridin-6-yl]methanone
CID 155132028
[(3R)-3-[[2-[6-[(3S,5S)-3-amino-5-fluoropiperidine-1-carbonyl]-3-methylimidazo[4,5-b]pyridin-2-yl]-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-5-yl]amino]piperidin-1-yl]-[2-[1-(cyclopropylmethyl)-5,6-difluoropyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]methanone
CID 155132049
[(3aR,7aR)-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridin-6-yl]-[2-[5-[[(3R)-1-[3-ethyl-2-(1-ethylpyrrolo[2,3-b]pyridin-2-yl)imidazo[4,5-b]pyridine-6-carbonyl]piperidin-3-yl]amino]-1-(2,2,2-trifluoroethyl)pyrrolo[2,3-b]pyridin-2-yl]-3-methylimidazo[4,5-b]pyridin-6-yl]methanone
CID 155132059
7-[[6-(3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrol-1-yl)-2-pyridinyl]amino]-4-[1-[[(6S)-4-[6-[[4-(8-fluoro-7-methylimidazo[1,2-a]pyridin-3-yl)-1-oxo-2,3-dihydropyrrolo[3,4-c]pyridin-7-yl]amino]-3-pyridinyl]-6-(2-hydroxypropan-2-yl)morpholin-3-yl]methyl]pyrrolo[2,3-b]pyridin-4-yl]-2,3-dihydropyrrolo[3,4-c]pyridin-1-one
CID 156652228

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide?
The IUPAC name of N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide (CID 159707318) is N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide?
The canonical SMILES for N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide is COCc1nc(C)n2ccc(C(=O)NC(C)(C)C3CC3)c2n1.Cc1nc(-c2ccccn2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2cccnc2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2cccnc2)nc2c(C(=O)NC(C)C3CC3)ccn12.Cc1nc(-c2ccncc2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.Cc1nc(-c2ccncc2)nc2c(C(=O)NC(C)C3CC3)ccn12.Cc1nc(COC2CC2)nc2c(C(=O)NC(C)(C)C3CC3)ccn12.
What is the InChIKey of N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide?
The InChIKey is MYJNHMKEOKURPS-UHFFFAOYSA-N. The full InChI is InChI=1S/3C19H21N5O.2C18H19N5O.C18H24N4O2.C16H22N4O2/c1-12-21-16(13-6-9-20-10-7-13)22-17-15(8-11-24(12)17)18(25)23-19(2,3)14-4-5-14;1-12-21-16(13-5-4-9-20-11-13)22-17-15(8-10-24(12)17)18(25)23-19(2,3)14-6-7-14;1-12-21-16(15-6-4-5-10-20-15)22-17-14(9-11-24(12)17)18(25)23-19(2,3)13-7-8-13;1-11(13-3-4-13)20-18(24)15-7-10-23-12(2)21-16(22-17(15)23)14-5-8-19-9-6-14;1-11(13-5-6-13)20-18(24)15-7-9-23-12(2)21-16(22-17(15)23)14-4-3-8-19-10-14;1-11-19-15(10-24-13-6-7-13)20-16-14(8-9-22(11)16)17(23)21-18(2,3)12-4-5-12;1-10-17-13(9-22-4)18-14-12(7-8-20(10)14)15(21)19-16(2,3)11-5-6-11/h6-11,14H,4-5H2,1-3H3,(H,23,25);4-5,8-11,14H,6-7H2,1-3H3,(H,23,25);4-6,9-11,13H,7-8H2,1-3H3,(H,23,25);5-11,13H,3-4H2,1-2H3,(H,20,24);3-4,7-11,13H,5-6H2,1-2H3,(H,20,24);8-9,12-13H,4-7,10H2,1-3H3,(H,21,23);7-8,11H,5-6,9H2,1-4H3,(H,19,21).
What are the key properties of N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide?
N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide has a molecular weight of 2279.79 g/mol, XLogP of 19.05, 31 rotatable bonds, 7 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(1-cyclopropylethyl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;2-(cyclopropyloxymethyl)-N-(2-cyclopropylpropan-2-yl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-2-(methoxymethyl)-4-methylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-2-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-3-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide;N-(2-cyclopropylpropan-2-yl)-4-methyl-2-pyridin-4-ylpyrrolo[1,2-a][1,3,5]triazine-8-carboxamide is sourced from PubChem (CID 159707318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).