2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide

C163H209ClN42O17 — CID 160924737

IUPAC2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide
SMILESCCCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21.CCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2cc3c(cc21)OCO3.CCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccc(Cl)cc21.COCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21.Cc1ccc2c(c1)c(CNCC1CCN(c3ncc(C(=O)NO)cn3)CC1)c(C)n2C.Cn1ccc2cc(CNCC3CCN(c4ncc(C(=O)NO)cn4)CC3)ccc21.O=C(NO)c1cnc(N2CCC(CNCc3cn(C4CCCC4)c4ccccc34)CC2)nc1
InChIInChI=1S/C25H32N6O2.C24H30N6O4.C24H32N6O2.C23H29ClN6O2.C23H30N6O3.C23H30N6O2.C21H26N6O2/c32-24(29-33)19-15-27-25(28-16-19)30-11-9-18(10-12-30)13-26-14-20-17-31(21-5-1-2-6-21)23-8-4-3-7-22(20)23;1-2-5-30-14-18(19-8-21-22(9-20(19)30)34-15-33-21)11-25-10-16-3-6-29(7-4-16)24-26-12-17(13-27-24)23(31)28-32;1-2-3-10-30-17-20(21-6-4-5-7-22(21)30)14-25-13-18-8-11-29(12-9-18)24-26-15-19(16-27-24)23(31)28-32;1-2-7-30-15-18(20-4-3-19(24)10-21(20)30)12-25-11-16-5-8-29(9-6-16)23-26-13-17(14-27-23)22(31)28-32;1-32-11-10-29-16-19(20-4-2-3-5-21(20)29)13-24-12-17-6-8-28(9-7-17)23-25-14-18(15-26-23)22(30)27-31;1-15-4-5-21-19(10-15)20(16(2)28(21)3)14-24-11-17-6-8-29(9-7-17)23-25-12-18(13-26-23)22(30)27-31;1-26-7-6-17-10-16(2-3-19(17)26)12-22-11-15-4-8-27(9-5-15)21-23-13-18(14-24-21)20(28)25-29/h3-4,7-8,15-18,21,26,33H,1-2,5-6,9-14H2,(H,29,32);8-9,12-14,16,25,32H,2-7,10-11,15H2,1H3,(H,28,31);4-7,15-18,25,32H,2-3,8-14H2,1H3,(H,28,31);3-4,10,13-16,25,32H,2,5-9,11-12H2,1H3,(H,28,31);2-5,14-17,24,31H,6-13H2,1H3,(H,27,30);4-5,10,12-13,17,24,31H,6-9,11,14H2,1-3H3,(H,27,30);2-3,6-7,10,13-15,22,29H,4-5,8-9,11-12H2,1H3,(H,25,28)
InChIKeySSMLOSRANICUFQ-UHFFFAOYSA-N
MW3064.19 g/mol
LogP20.35
Rot. Bonds53

About 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide

2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide (PubChem CID 160924737) has the molecular formula C163H209ClN42O17 and a molecular weight of 3064.19 g/mol. Its IUPAC name is 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide
PubChem CID160924737
Molecular FormulaC163H209ClN42O17
Molecular Weight3064.19 g/mol
Exact Mass3061.65
IUPAC Name2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide
SMILESCCCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21.CCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2cc3c(cc21)OCO3.CCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccc(Cl)cc21.COCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21.Cc1ccc2c(c1)c(CNCC1CCN(c3ncc(C(=O)NO)cn3)CC1)c(C)n2C.Cn1ccc2cc(CNCC3CCN(c4ncc(C(=O)NO)cn4)CC3)ccc21.O=C(NO)c1cnc(N2CCC(CNCc3cn(C4CCCC4)c4ccccc34)CC2)nc1
InChIInChI=1S/C25H32N6O2.C24H30N6O4.C24H32N6O2.C23H29ClN6O2.C23H30N6O3.C23H30N6O2.C21H26N6O2/c32-24(29-33)19-15-27-25(28-16-19)30-11-9-18(10-12-30)13-26-14-20-17-31(21-5-1-2-6-21)23-8-4-3-7-22(20)23;1-2-5-30-14-18(19-8-21-22(9-20(19)30)34-15-33-21)11-25-10-16-3-6-29(7-4-16)24-26-12-17(13-27-24)23(31)28-32;1-2-3-10-30-17-20(21-6-4-5-7-22(21)30)14-25-13-18-8-11-29(12-9-18)24-26-15-19(16-27-24)23(31)28-32;1-2-7-30-15-18(20-4-3-19(24)10-21(20)30)12-25-11-16-5-8-29(9-6-16)23-26-13-17(14-27-23)22(31)28-32;1-32-11-10-29-16-19(20-4-2-3-5-21(20)29)13-24-12-17-6-8-28(9-7-17)23-25-14-18(15-26-23)22(30)27-31;1-15-4-5-21-19(10-15)20(16(2)28(21)3)14-24-11-17-6-8-29(9-7-17)23-25-12-18(13-26-23)22(30)27-31;1-26-7-6-17-10-16(2-3-19(17)26)12-22-11-15-4-8-27(9-5-15)21-23-13-18(14-24-21)20(28)25-29/h3-4,7-8,15-18,21,26,33H,1-2,5-6,9-14H2,(H,29,32);8-9,12-14,16,25,32H,2-7,10-11,15H2,1H3,(H,28,31);4-7,15-18,25,32H,2-3,8-14H2,1H3,(H,28,31);3-4,10,13-16,25,32H,2,5-9,11-12H2,1H3,(H,28,31);2-5,14-17,24,31H,6-13H2,1H3,(H,27,30);4-5,10,12-13,17,24,31H,6-9,11,14H2,1-3H3,(H,27,30);2-3,6-7,10,13-15,22,29H,4-5,8-9,11-12H2,1H3,(H,25,28)
InChIKeySSMLOSRANICUFQ-UHFFFAOYSA-N
XLogP20.35
TPSA694.86 Ų
H-Bond Donors21
H-Bond Acceptors52
Rotatable Bonds53
Heavy Atoms223
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003064.19
LogP ≤ 520.35
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1052

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-[[2-(5-chloro-1-methylindol-3-yl)ethylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(5-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[2-(1,2-dimethylindol-3-yl)ethylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[ethyl-[2-(6-methoxy-1-propylindol-3-yl)ethyl]amino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[2-(6-methoxy-1-methylindol-3-yl)ethylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide
CID 157223163
[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[4-[bis(4-chlorophenyl)methyl]piperazine-1-carbonyl]-N-cyclopropylpyrazole-4-carboxamide;[1-[4-[bis(4-chlorophenyl)methyl]piperazine-1-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;[4-[(4-chloro-2-pyrrolidin-1-ylphenyl)methyl]piperazin-1-yl]-(4-methylpyrazol-1-yl)methanone;morpholin-4-yl-[1-[4-(pyridin-3-ylmethyl)piperazine-1-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[4-(pyrimidin-4-ylmethyl)piperazine-1-carbonyl]pyrazol-4-yl]methanone
CID 158250513
N-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide;N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-methoxy-5-methylphenyl)acetamide;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(5-methyl-2-pyridinyl)acetamide;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-pentan-2-ylacetamide;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2,4,6-trimethylphenyl)acetamide;methane
CID 159966210
2-[4-[[(4-chloro-1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(5,6-dimethoxy-1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-ethyl-6-methoxyindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-methyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide
CID 160088264
2-[4-[[(5-chloro-1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-ethylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(7-fluoro-1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-methoxy-1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[2-(2-methyl-1H-indol-3-yl)ethylamino]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[2-(1-propylindol-3-yl)ethylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide
CID 160419700
2-[4-[[acetyl-[(1-methylindol-3-yl)methyl]amino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[2-(5-chloro-1-methylindol-3-yl)ethyl-propanoylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[ethyl-[(1-methylindol-3-yl)methyl]amino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[2-(6-methoxy-1-methylindol-3-yl)ethyl-propanoylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[2-(1-methylindol-3-yl)ethyl-propanoylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide
CID 161582238

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide?
The IUPAC name of 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide (CID 160924737) is 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide.
What is the SMILES notation for 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide?
The canonical SMILES for 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide is CCCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21.CCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2cc3c(cc21)OCO3.CCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccc(Cl)cc21.COCCn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21.Cc1ccc2c(c1)c(CNCC1CCN(c3ncc(C(=O)NO)cn3)CC1)c(C)n2C.Cn1ccc2cc(CNCC3CCN(c4ncc(C(=O)NO)cn4)CC3)ccc21.O=C(NO)c1cnc(N2CCC(CNCc3cn(C4CCCC4)c4ccccc34)CC2)nc1.
What is the InChIKey of 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide?
The InChIKey is SSMLOSRANICUFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N6O2.C24H30N6O4.C24H32N6O2.C23H29ClN6O2.C23H30N6O3.C23H30N6O2.C21H26N6O2/c32-24(29-33)19-15-27-25(28-16-19)30-11-9-18(10-12-30)13-26-14-20-17-31(21-5-1-2-6-21)23-8-4-3-7-22(20)23;1-2-5-30-14-18(19-8-21-22(9-20(19)30)34-15-33-21)11-25-10-16-3-6-29(7-4-16)24-26-12-17(13-27-24)23(31)28-32;1-2-3-10-30-17-20(21-6-4-5-7-22(21)30)14-25-13-18-8-11-29(12-9-18)24-26-15-19(16-27-24)23(31)28-32;1-2-7-30-15-18(20-4-3-19(24)10-21(20)30)12-25-11-16-5-8-29(9-6-16)23-26-13-17(14-27-23)22(31)28-32;1-32-11-10-29-16-19(20-4-2-3-5-21(20)29)13-24-12-17-6-8-28(9-7-17)23-25-14-18(15-26-23)22(30)27-31;1-15-4-5-21-19(10-15)20(16(2)28(21)3)14-24-11-17-6-8-29(9-7-17)23-25-12-18(13-26-23)22(30)27-31;1-26-7-6-17-10-16(2-3-19(17)26)12-22-11-15-4-8-27(9-5-15)21-23-13-18(14-24-21)20(28)25-29/h3-4,7-8,15-18,21,26,33H,1-2,5-6,9-14H2,(H,29,32);8-9,12-14,16,25,32H,2-7,10-11,15H2,1H3,(H,28,31);4-7,15-18,25,32H,2-3,8-14H2,1H3,(H,28,31);3-4,10,13-16,25,32H,2,5-9,11-12H2,1H3,(H,28,31);2-5,14-17,24,31H,6-13H2,1H3,(H,27,30);4-5,10,12-13,17,24,31H,6-9,11,14H2,1-3H3,(H,27,30);2-3,6-7,10,13-15,22,29H,4-5,8-9,11-12H2,1H3,(H,25,28).
What are the key properties of 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide?
2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide has a molecular weight of 3064.19 g/mol, XLogP of 20.35, 53 rotatable bonds, 21 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[(1-butylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(6-chloro-1-propylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;2-[4-[[(1-cyclopentylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-hydroxy-2-[4-[[[1-(2-methoxyethyl)indol-3-yl]methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1-methylindol-5-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(5-propyl-[1,3]dioxolo[4,5-f]indol-7-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide;N-hydroxy-2-[4-[[(1,2,5-trimethylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide is sourced from PubChem (CID 160924737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).