2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C106H106F15N43O8 — CID 161356948

IUPAC2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN1CCN(c2ccncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Cc1ccncc1NC(=O)c1c(N)nn2ccc(C(F)(F)F)nc12.Cc1ccncc1NC(=O)c1c(N)nn2ccc(OCCN(C)C)nc12.NCC1CCN(c2ccncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Nc1nn2ccc(C(F)(F)F)nc2c1C(=O)Nc1cnccc1-c1ccccc1.Nc1nn2ccc(C(F)(F)F)nc2c1C(=O)Nc1cnccc1N1CCN(CCO)CC1
InChIInChI=1S/C19H21F3N8O2.C19H21F3N8O.C19H13F3N6O.C18H19F3N8O.C17H21N7O2.C14H11F3N6O/c20-19(21,22)14-2-4-30-17(26-14)15(16(23)27-30)18(32)25-12-11-24-3-1-13(12)29-7-5-28(6-8-29)9-10-31;20-19(21,22)14-4-8-30-17(27-14)15(16(24)28-30)18(31)26-12-10-25-5-1-13(12)29-6-2-11(9-23)3-7-29;20-19(21,22)14-7-9-28-17(26-14)15(16(23)27-28)18(29)25-13-10-24-8-6-12(13)11-4-2-1-3-5-11;1-27-6-8-28(9-7-27)12-2-4-23-10-11(12)24-17(30)14-15(22)26-29-5-3-13(18(19,20)21)25-16(14)29;1-11-4-6-19-10-12(11)20-17(25)14-15(18)22-24-7-5-13(21-16(14)24)26-9-8-23(2)3;1-7-2-4-19-6-8(7)20-13(24)10-11(18)22-23-5-3-9(14(15,16)17)21-12(10)23/h1-4,11,31H,5-10H2,(H2,23,27)(H,25,32);1,4-5,8,10-11H,2-3,6-7,9,23H2,(H2,24,28)(H,26,31);1-10H,(H2,23,27)(H,25,29);2-5,10H,6-9H2,1H3,(H2,22,26)(H,24,30);4-7,10H,8-9H2,1-3H3,(H2,18,22)(H,20,25);2-6H,1H3,(H2,18,22)(H,20,24)
InChIKeyVORBVRBADRYYEK-UHFFFAOYSA-N
MW2395.28 g/mol
LogP12.11
Rot. Bonds23

About 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 161356948) has the molecular formula C106H106F15N43O8 and a molecular weight of 2395.28 g/mol. Its IUPAC name is 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID161356948
Molecular FormulaC106H106F15N43O8
Molecular Weight2395.28 g/mol
Exact Mass2393.90
IUPAC Name2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN1CCN(c2ccncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Cc1ccncc1NC(=O)c1c(N)nn2ccc(C(F)(F)F)nc12.Cc1ccncc1NC(=O)c1c(N)nn2ccc(OCCN(C)C)nc12.NCC1CCN(c2ccncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Nc1nn2ccc(C(F)(F)F)nc2c1C(=O)Nc1cnccc1-c1ccccc1.Nc1nn2ccc(C(F)(F)F)nc2c1C(=O)Nc1cnccc1N1CCN(CCO)CC1
InChIInChI=1S/C19H21F3N8O2.C19H21F3N8O.C19H13F3N6O.C18H19F3N8O.C17H21N7O2.C14H11F3N6O/c20-19(21,22)14-2-4-30-17(26-14)15(16(23)27-30)18(32)25-12-11-24-3-1-13(12)29-7-5-28(6-8-29)9-10-31;20-19(21,22)14-4-8-30-17(27-14)15(16(24)28-30)18(31)26-12-10-25-5-1-13(12)29-6-2-11(9-23)3-7-29;20-19(21,22)14-7-9-28-17(26-14)15(16(23)27-28)18(29)25-13-10-24-8-6-12(13)11-4-2-1-3-5-11;1-27-6-8-28(9-7-27)12-2-4-23-10-11(12)24-17(30)14-15(22)26-29-5-3-13(18(19,20)21)25-16(14)29;1-11-4-6-19-10-12(11)20-17(25)14-15(18)22-24-7-5-13(21-16(14)24)26-9-8-23(2)3;1-7-2-4-19-6-8(7)20-13(24)10-11(18)22-23-5-3-9(14(15,16)17)21-12(10)23/h1-4,11,31H,5-10H2,(H2,23,27)(H,25,32);1,4-5,8,10-11H,2-3,6-7,9,23H2,(H2,24,28)(H,26,31);1-10H,(H2,23,27)(H,25,29);2-5,10H,6-9H2,1H3,(H2,22,26)(H,24,30);4-7,10H,8-9H2,1-3H3,(H2,18,22)(H,20,25);2-6H,1H3,(H2,18,22)(H,20,24)
InChIKeyVORBVRBADRYYEK-UHFFFAOYSA-N
XLogP12.11
TPSA664.12 Ų
H-Bond Donors14
H-Bond Acceptors45
Rotatable Bonds23
Heavy Atoms172
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002395.28
LogP ≤ 512.11
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1045

Analyze 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-1-[[6-[[3-ethyl-4-[[7-(morpholin-2-ylmethoxy)imidazo[1,2-a]pyridine-3-carbonyl]amino]indazol-1-yl]methyl]-2-pyridinyl]methyl]-7-[2-(3-fluoropyrrolidin-1-yl)ethoxy]imidazo[1,2-a]pyridin-1-ium-3-carboxamide
CID 123604695
N-[2-(1,3-dihydroxy-2-methylpropan-2-yl)oxypyrimidin-4-yl]-1-[6-[(3-methyloxetan-3-yl)methoxy]-2-[[6-[2-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazine-3-carbonyl]amino]pyrimidin-4-yl]-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazin-1-ium-3-carboxamide
CID 123634883
2-amino-N-[4-[[6-[(Z)-2-[[3-[[4-[4-(dimethylamino)cyclohexyl]oxy-3-pyridinyl]carbamoyl]-4-iminopentan-2-ylidene]amino]-3,3,3-trifluoroprop-1-enyl]-1-azabicyclo[2.2.2]octan-3-yl]oxy]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 123884781
6-(3-fluoropyrrolidin-1-yl)-N-(6-morpholin-4-yl-2-pyridinyl)-8-[[6-[[5-[2-(trifluoromethyl)phenyl]-1-[[6-[[5-[2-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]-2-pyridinyl]oxy]pyrazolo[1,5-a]pyrimidin-1-ium-3-carbonyl]amino]-2-pyridinyl]oxymethyl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 124017564
(3R,13R)-8-fluoro-13-[[(3S,14R)-8-fluoro-3-(fluoromethyl)-14-methyl-16-oxo-12-oxa-4,10,15,19,20,22-hexazapentacyclo[18.3.1.04,23.06,11.017,21]tetracosa-1(24),6(11),7,9,17(21),18,22-heptaen-24-yl]methyl]-25-[[(3R,13S)-8-fluoro-3-methyl-16-oxo-12-oxa-4,10,15,19,20,22-hexazapentacyclo[18.3.1.04,23.06,11.017,21]tetracosa-1(24),6(11),7,9,17(21),18,22-heptaen-13-yl]methyl]-3-methyl-12-oxa-4,10,16,20,21,23-hexazapentacyclo[19.3.1.04,24.06,11.018,22]pentacosa-1(25),6(11),7,9,18(22),19,23-heptaen-17-one
CID 156082104
2-amino-N-[4-(cyclopropylmethoxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,4-dioxaspiro[4.5]decan-8-yloxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(2-methoxyethoxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[(3R)-oxolan-3-yl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[(3S)-oxolan-3-yl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 157117375
CID 157199709
CID 157199709
2-amino-N-[4-(1,4-dioxaspiro[4.5]decan-8-yloxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(2-methoxyethoxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(oxan-3-yloxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(oxan-4-yloxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[(3R)-oxolan-3-yl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[(3S)-oxolan-3-yl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 157377154
2-amino-6-(cyanomethyl)-N-(4-cyclobutyloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-(cyanomethyl)-N-[4-(cyclopropylmethoxy)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-(cyanomethyl)-N-[4-(2-hydroxyethoxy)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-(cyanomethyl)-N-(4-propan-2-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-(cyanomethyl)-N-[4-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 157571975
N-[2-[[5-[3-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-b]pyridazin-6-yl]-2-pyridinyl]oxy]ethyl]cyclopropanecarboxamide;N-[3-[[5-[3-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-b]pyridazin-6-yl]-2-pyridinyl]oxy]propyl]-2-methylpropanamide;N-[3-[[5-[3-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazin-6-yl]-2-pyridinyl]oxy]propyl]cyclopropanecarboxamide;N-[3-[[5-[3-[2-(trifluoromethyl)-4-pyridinyl]imidazo[1,2-b]pyridazin-6-yl]-2-pyridinyl]oxy]propyl]cyclopropanecarboxamide
CID 157597360
1-[3-[(2R)-2,3-dihydroxypropoxy]-4-methyl-1-phenylpyrazol-5-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-[3-[3-hydroxy-2-(hydroxymethyl)propoxy]-4-methyl-1-phenylpyrazol-5-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-[3-(2-hydroxy-2-methylpropoxy)-4-methyl-1-phenylpyrazol-5-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea;1-[3-[(2R)-2-hydroxypropoxy]-4-methyl-1-phenylpyrazol-5-yl]-3-[2-phenyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 157932253
2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[3-(dimethylamino)cyclobutyl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(dimethylamino)cyclohexyl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 157937022

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 161356948) is 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CN1CCN(c2ccncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Cc1ccncc1NC(=O)c1c(N)nn2ccc(C(F)(F)F)nc12.Cc1ccncc1NC(=O)c1c(N)nn2ccc(OCCN(C)C)nc12.NCC1CCN(c2ccncc2NC(=O)c2c(N)nn3ccc(C(F)(F)F)nc23)CC1.Nc1nn2ccc(C(F)(F)F)nc2c1C(=O)Nc1cnccc1-c1ccccc1.Nc1nn2ccc(C(F)(F)F)nc2c1C(=O)Nc1cnccc1N1CCN(CCO)CC1.
What is the InChIKey of 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is VORBVRBADRYYEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F3N8O2.C19H21F3N8O.C19H13F3N6O.C18H19F3N8O.C17H21N7O2.C14H11F3N6O/c20-19(21,22)14-2-4-30-17(26-14)15(16(23)27-30)18(32)25-12-11-24-3-1-13(12)29-7-5-28(6-8-29)9-10-31;20-19(21,22)14-4-8-30-17(27-14)15(16(24)28-30)18(31)26-12-10-25-5-1-13(12)29-6-2-11(9-23)3-7-29;20-19(21,22)14-7-9-28-17(26-14)15(16(23)27-28)18(29)25-13-10-24-8-6-12(13)11-4-2-1-3-5-11;1-27-6-8-28(9-7-27)12-2-4-23-10-11(12)24-17(30)14-15(22)26-29-5-3-13(18(19,20)21)25-16(14)29;1-11-4-6-19-10-12(11)20-17(25)14-15(18)22-24-7-5-13(21-16(14)24)26-9-8-23(2)3;1-7-2-4-19-6-8(7)20-13(24)10-11(18)22-23-5-3-9(14(15,16)17)21-12(10)23/h1-4,11,31H,5-10H2,(H2,23,27)(H,25,32);1,4-5,8,10-11H,2-3,6-7,9,23H2,(H2,24,28)(H,26,31);1-10H,(H2,23,27)(H,25,29);2-5,10H,6-9H2,1H3,(H2,22,26)(H,24,30);4-7,10H,8-9H2,1-3H3,(H2,18,22)(H,20,25);2-6H,1H3,(H2,18,22)(H,20,24).
What are the key properties of 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 2395.28 g/mol, XLogP of 12.11, 23 rotatable bonds, 14 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-[4-(aminomethyl)piperidin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-5-[2-(dimethylamino)ethoxy]-N-(4-methyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(4-methylpiperazin-1-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-methyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-phenyl-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 161356948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).