[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone

C145H193F4N37O9 — CID 159208741

IUPAC[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone
SMILESC=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3cccc(C)c3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3cccc(N4CCOCC4)c3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3C(F)(F)F)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3C)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3F)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3N3CCCC3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3OC)CC2)c1
InChIInChI=1S/C23H32N6O2.C23H32N6O.C20H24F3N5O.C20H27N5O2.2C20H27N5O.C19H24FN5O/c1-19(2)25(3)22-16-24-29(18-22)23(30)28-9-7-26(8-10-28)17-20-5-4-6-21(15-20)27-11-13-31-14-12-27;1-19(2)25(3)21-16-24-29(18-21)23(30)28-14-12-26(13-15-28)17-20-8-4-5-9-22(20)27-10-6-7-11-27;1-15(2)25(3)17-12-24-28(14-17)19(29)27-10-8-26(9-11-27)13-16-6-4-5-7-18(16)20(21,22)23;1-16(2)22(3)18-13-21-25(15-18)20(26)24-11-9-23(10-12-24)14-17-7-5-6-8-19(17)27-4;1-16(2)22(4)19-13-21-25(15-19)20(26)24-10-8-23(9-11-24)14-18-7-5-6-17(3)12-18;1-16(2)22(4)19-13-21-25(15-19)20(26)24-11-9-23(10-12-24)14-18-8-6-5-7-17(18)3;1-15(2)22(3)17-12-21-25(14-17)19(26)24-10-8-23(9-11-24)13-16-6-4-5-7-18(16)20/h4-6,15-16,18H,1,7-14,17H2,2-3H3;4-5,8-9,16,18H,1,6-7,10-15,17H2,2-3H3;4-7,12,14H,1,8-11,13H2,2-3H3;5-8,13,15H,1,9-12,14H2,2-4H3;5-7,12-13,15H,1,8-11,14H2,2-4H3;5-8,13,15H,1,9-12,14H2,2-4H3;4-7,12,14H,1,8-11,13H2,2-3H3
InChIKeyKQFIVVQHMKWBSO-UHFFFAOYSA-N
MW2674.38 g/mol
LogP20.69
Rot. Bonds31

About [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone

[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone (PubChem CID 159208741) has the molecular formula C145H193F4N37O9 and a molecular weight of 2674.38 g/mol. Its IUPAC name is [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Name[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone
PubChem CID159208741
Molecular FormulaC145H193F4N37O9
Molecular Weight2674.38 g/mol
Exact Mass2672.57
IUPAC Name[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone
SMILESC=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3cccc(C)c3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3cccc(N4CCOCC4)c3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3C(F)(F)F)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3C)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3F)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3N3CCCC3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3OC)CC2)c1
InChIInChI=1S/C23H32N6O2.C23H32N6O.C20H24F3N5O.C20H27N5O2.2C20H27N5O.C19H24FN5O/c1-19(2)25(3)22-16-24-29(18-22)23(30)28-9-7-26(8-10-28)17-20-5-4-6-21(15-20)27-11-13-31-14-12-27;1-19(2)25(3)21-16-24-29(18-21)23(30)28-14-12-26(13-15-28)17-20-8-4-5-9-22(20)27-10-6-7-11-27;1-15(2)25(3)17-12-24-28(14-17)19(29)27-10-8-26(9-11-27)13-16-6-4-5-7-18(16)20(21,22)23;1-16(2)22(3)18-13-21-25(15-18)20(26)24-11-9-23(10-12-24)14-17-7-5-6-8-19(17)27-4;1-16(2)22(4)19-13-21-25(15-19)20(26)24-10-8-23(9-11-24)14-18-7-5-6-17(3)12-18;1-16(2)22(4)19-13-21-25(15-19)20(26)24-11-9-23(10-12-24)14-18-8-6-5-7-17(18)3;1-15(2)22(3)17-12-21-25(14-17)19(26)24-10-8-23(9-11-24)13-16-6-4-5-7-18(16)20/h4-6,15-16,18H,1,7-14,17H2,2-3H3;4-5,8-9,16,18H,1,6-7,10-15,17H2,2-3H3;4-7,12,14H,1,8-11,13H2,2-3H3;5-8,13,15H,1,9-12,14H2,2-4H3;5-7,12-13,15H,1,8-11,14H2,2-4H3;5-8,13,15H,1,9-12,14H2,2-4H3;4-7,12,14H,1,8-11,13H2,2-3H3
InChIKeyKQFIVVQHMKWBSO-UHFFFAOYSA-N
XLogP20.69
TPSA337.21 Ų
H-Bond Donors
H-Bond Acceptors39
Rotatable Bonds31
Heavy Atoms195
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002674.38
LogP ≤ 520.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1039

Analyze [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone with MolForge

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Related Compounds

CID 159426021
CID 159426021
1-tert-butyl-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea;1-cyclohexyl-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea;N-[[2-(difluoromethoxy)phenyl]methyl]-N-methyl-1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-amine;1-(3-fluorophenyl)-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea;1-(2-methoxyphenyl)-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea;1-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]-3-[3-(trifluoromethyl)phenyl]urea;1-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 159707001
[2-[(2-Chlorophenyl)methyl]-2,7-diazaspiro[3.5]nonan-7-yl]-(4-methylpyrazol-1-yl)methanone;[2-[(2-fluorophenyl)methyl]-2,7-diazaspiro[3.5]nonan-7-yl]-(4-methylpyrazol-1-yl)methanone;[2-[(2-methoxyphenyl)methyl]-2,7-diazaspiro[3.5]nonan-7-yl]-(4-methylpyrazol-1-yl)methanone;[2-[(2-methylphenyl)methyl]-2,7-diazaspiro[3.5]nonan-7-yl]-(4-methylpyrazol-1-yl)methanone;(4-methylpyrazol-1-yl)-[2-[(2-pyrrolidin-1-ylphenyl)methyl]-2,7-diazaspiro[3.5]nonan-7-yl]methanone;(4-methylpyrazol-1-yl)-[2-[[2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[3.5]nonan-7-yl]methanone
CID 160664048
Pentakis((4-methylpyrazol-1-yl)-[4-(naphthalen-2-ylmethyl)piperazin-1-yl]methanone);bis((4-methylpyrazol-1-yl)-[4-[(4-phenoxyphenyl)methyl]piperazin-1-yl]methanone);(4-methylpyrazol-1-yl)-[4-[(4-phenylmethoxyphenyl)methyl]piperazin-1-yl]methanone;[4-[(4-phenoxyphenyl)methyl]piperazin-1-yl]-pyrazol-1-ylmethanone;[4-[(4-phenylmethoxyphenyl)methyl]piperazin-1-yl]-pyrazol-1-ylmethanone
CID 157283758
[4-[(2-Chlorophenyl)methyl]piperazin-1-yl]-(4-methylpyrazol-1-yl)methanone;[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-(4-methylpyrazol-1-yl)methanone;[4-[[3-(hydroxymethyl)phenyl]methyl]piperazin-1-yl]-(4-methylpyrazol-1-yl)methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-(4-methylpyrazol-1-yl)methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-(4-methylpyrazol-1-yl)methanone;bis([4-[(3-methylphenyl)methyl]piperazin-1-yl]-(4-methylpyrazol-1-yl)methanone);(4-methylpyrazol-1-yl)-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;(4-methylpyrazol-1-yl)-[4-[(3-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone
CID 157993558
[4-[(2-Chloro-4-morpholin-4-ylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methyl-4-morpholin-4-ylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone
CID 158577119
[4-[(2-Chloro-4-phenylphenyl)methyl]piperazin-1-yl]-[4-[(methyl-methylidene-oxo-lambda6-sulfanyl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxy-4-phenylphenyl)methyl]piperazin-1-yl]-[4-[(methyl-methylidene-oxo-lambda6-sulfanyl)amino]pyrazol-1-yl]methanone;[4-[(methyl-methylidene-oxo-lambda6-sulfanyl)amino]pyrazol-1-yl]-[4-[(2-methyl-4-phenylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl-(methyl-methylidene-oxo-lambda6-sulfanyl)amino]pyrazol-1-yl]-[4-[(4-methyl-2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[(4-methyl-2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]-[4-(prop-1-en-2-ylamino)pyrazol-1-yl]methanone
CID 160090392
1-tert-butyl-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea;1-cyclohexyl-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea;N-[[2-(difluoromethoxy)phenyl]methyl]-N-methyl-1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-amine;1-(2,4-difluorophenyl)-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea;N-[(2-ethoxyphenyl)methyl]-N-methyl-1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-amine;1-(4-fluorophenyl)-3-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]urea
CID 161774020
(2-benzylpiperidin-1-yl)-[4-(4-methylphenyl)triazol-2-yl]methanone;[(2R)-2-benzylpiperidin-1-yl]-[4-(4-methylphenyl)triazol-2-yl]methanone;[4-(4-methylphenyl)triazol-1-yl]-[2-(phenoxymethyl)piperidin-1-yl]methanone;[4-(4-methylphenyl)triazol-2-yl]-[2-(phenoxymethyl)piperidin-1-yl]methanone;[4-(4-methylphenyl)triazol-1-yl]-[6-(phenylmethoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-(4-methylphenyl)triazol-1-yl]-[(6R)-6-(phenylmethoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-(4-methylphenyl)triazol-2-yl]-[6-(phenylmethoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-(4-methylphenyl)triazol-2-yl]-[(6R)-6-(phenylmethoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CID 161860981

Frequently Asked Questions

What is the IUPAC name of [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone?
The IUPAC name of [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone (CID 159208741) is [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone.
What is the SMILES notation for [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone?
The canonical SMILES for [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone is C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3cccc(C)c3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3cccc(N4CCOCC4)c3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3C(F)(F)F)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3C)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3F)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3N3CCCC3)CC2)c1.C=C(C)N(C)c1cnn(C(=O)N2CCN(Cc3ccccc3OC)CC2)c1.
What is the InChIKey of [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone?
The InChIKey is KQFIVVQHMKWBSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N6O2.C23H32N6O.C20H24F3N5O.C20H27N5O2.2C20H27N5O.C19H24FN5O/c1-19(2)25(3)22-16-24-29(18-22)23(30)28-9-7-26(8-10-28)17-20-5-4-6-21(15-20)27-11-13-31-14-12-27;1-19(2)25(3)21-16-24-29(18-21)23(30)28-14-12-26(13-15-28)17-20-8-4-5-9-22(20)27-10-6-7-11-27;1-15(2)25(3)17-12-24-28(14-17)19(29)27-10-8-26(9-11-27)13-16-6-4-5-7-18(16)20(21,22)23;1-16(2)22(3)18-13-21-25(15-18)20(26)24-11-9-23(10-12-24)14-17-7-5-6-8-19(17)27-4;1-16(2)22(4)19-13-21-25(15-19)20(26)24-10-8-23(9-11-24)14-18-7-5-6-17(3)12-18;1-16(2)22(4)19-13-21-25(15-19)20(26)24-11-9-23(10-12-24)14-18-8-6-5-7-17(18)3;1-15(2)22(3)17-12-21-25(14-17)19(26)24-10-8-23(9-11-24)13-16-6-4-5-7-18(16)20/h4-6,15-16,18H,1,7-14,17H2,2-3H3;4-5,8-9,16,18H,1,6-7,10-15,17H2,2-3H3;4-7,12,14H,1,8-11,13H2,2-3H3;5-8,13,15H,1,9-12,14H2,2-4H3;5-7,12-13,15H,1,8-11,14H2,2-4H3;5-8,13,15H,1,9-12,14H2,2-4H3;4-7,12,14H,1,8-11,13H2,2-3H3.
What are the key properties of [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone?
[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone has a molecular weight of 2674.38 g/mol, XLogP of 20.69, 31 rotatable bonds, 0 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(2-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(3-morpholin-4-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[(2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]methanone;[4-[methyl(prop-1-en-2-yl)amino]pyrazol-1-yl]-[4-[[2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone is sourced from PubChem (CID 159208741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).