N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide

C182H207FN36O14 — CID 158442288

IUPACN-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide
SMILESCOc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCC5)nc4C)c3)c2)c1.COc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cnn(CCN5CCCCC5)c4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCC5)nc4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCCC5)nc4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cnn(CCN5CCCC5)c4C)c3)c2)c1.Cc1nn(CCN2CCCCC2)cc1CC(=O)c1cccc(-n2cc(CC(=O)Nc3ccccc3F)cn2)c1
InChIInChI=1S/C31H36N6O3.C31H36N6O2.C30H33FN6O2.C30H34N6O3.2C30H34N6O2/c1-23-26(21-33-36(23)15-14-35-12-4-3-5-13-35)18-30(38)25-8-6-10-28(17-25)37-22-24(20-32-37)16-31(39)34-27-9-7-11-29(19-27)40-2;1-23-8-6-10-28(16-23)33-31(39)17-25-20-32-37(21-25)29-11-7-9-26(18-29)30(38)19-27-22-36(34-24(27)2)15-14-35-12-4-3-5-13-35;1-22-25(21-36(34-22)15-14-35-12-5-2-6-13-35)18-29(38)24-8-7-9-26(17-24)37-20-23(19-32-37)16-30(39)33-28-11-4-3-10-27(28)31;1-22-25(21-35(33-22)14-13-34-11-3-4-12-34)17-29(37)24-7-5-9-27(16-24)36-20-23(19-31-36)15-30(38)32-26-8-6-10-28(18-26)39-2;1-22-7-5-9-27(15-22)33-30(38)16-24-19-31-36(21-24)28-10-6-8-25(17-28)29(37)18-26-20-32-35(23(26)2)14-13-34-11-3-4-12-34;1-22-7-5-9-27(15-22)32-30(38)16-24-19-31-36(20-24)28-10-6-8-25(17-28)29(37)18-26-21-35(33-23(26)2)14-13-34-11-3-4-12-34/h6-11,17,19-22H,3-5,12-16,18H2,1-2H3,(H,34,39);6-11,16,18,20-22H,3-5,12-15,17,19H2,1-2H3,(H,33,39);3-4,7-11,17,19-21H,2,5-6,12-16,18H2,1H3,(H,33,39);5-10,16,18-21H,3-4,11-15,17H2,1-2H3,(H,32,38);5-10,15,17,19-21H,3-4,11-14,16,18H2,1-2H3,(H,33,38);5-10,15,17,19-21H,3-4,11-14,16,18H2,1-2H3,(H,32,38)
InChIKeyHCYVCQDTLGFRKL-UHFFFAOYSA-N
MW3141.89 g/mol
LogP26.73
Rot. Bonds62

About N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide

N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide (PubChem CID 158442288) has the molecular formula C182H207FN36O14 and a molecular weight of 3141.89 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide
PubChem CID158442288
Molecular FormulaC182H207FN36O14
Molecular Weight3141.89 g/mol
Exact Mass3139.66
IUPAC NameN-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide
SMILESCOc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCC5)nc4C)c3)c2)c1.COc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cnn(CCN5CCCCC5)c4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCC5)nc4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCCC5)nc4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cnn(CCN5CCCC5)c4C)c3)c2)c1.Cc1nn(CCN2CCCCC2)cc1CC(=O)c1cccc(-n2cc(CC(=O)Nc3ccccc3F)cn2)c1
InChIInChI=1S/C31H36N6O3.C31H36N6O2.C30H33FN6O2.C30H34N6O3.2C30H34N6O2/c1-23-26(21-33-36(23)15-14-35-12-4-3-5-13-35)18-30(38)25-8-6-10-28(17-25)37-22-24(20-32-37)16-31(39)34-27-9-7-11-29(19-27)40-2;1-23-8-6-10-28(16-23)33-31(39)17-25-20-32-37(21-25)29-11-7-9-26(18-29)30(38)19-27-22-36(34-24(27)2)15-14-35-12-4-3-5-13-35;1-22-25(21-36(34-22)15-14-35-12-5-2-6-13-35)18-29(38)24-8-7-9-26(17-24)37-20-23(19-32-37)16-30(39)33-28-11-4-3-10-27(28)31;1-22-25(21-35(33-22)14-13-34-11-3-4-12-34)17-29(37)24-7-5-9-27(16-24)36-20-23(19-31-36)15-30(38)32-26-8-6-10-28(18-26)39-2;1-22-7-5-9-27(15-22)33-30(38)16-24-19-31-36(21-24)28-10-6-8-25(17-28)29(37)18-26-20-32-35(23(26)2)14-13-34-11-3-4-12-34;1-22-7-5-9-27(15-22)32-30(38)16-24-19-31-36(20-24)28-10-6-8-25(17-28)29(37)18-26-21-35(33-23(26)2)14-13-34-11-3-4-12-34/h6-11,17,19-22H,3-5,12-16,18H2,1-2H3,(H,34,39);6-11,16,18,20-22H,3-5,12-15,17,19H2,1-2H3,(H,33,39);3-4,7-11,17,19-21H,2,5-6,12-16,18H2,1H3,(H,33,39);5-10,16,18-21H,3-4,11-15,17H2,1-2H3,(H,32,38);5-10,15,17,19-21H,3-4,11-14,16,18H2,1-2H3,(H,33,38);5-10,15,17,19-21H,3-4,11-14,16,18H2,1-2H3,(H,32,38)
InChIKeyHCYVCQDTLGFRKL-UHFFFAOYSA-N
XLogP26.73
TPSA528.76 Ų
H-Bond Donors6
H-Bond Acceptors44
Rotatable Bonds62
Heavy Atoms233
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003141.89
LogP ≤ 526.73
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1044

Analyze N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide with MolForge

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Related Compounds

N-(2-chlorophenyl)-2-[1-[3-[2-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-[2-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]ethanethioamide;1-(2-chlorophenyl)-3-[1-[3-[2-[1-(piperidin-4-ylmethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]urea;N-cyclopentyl-2-[1-[3-[2-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-cyclopentyl-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;1-(2-methylphenyl)-3-[1-[3-[2-[1-(piperidin-4-ylmethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]urea
CID 159606392
N-(2-chlorophenyl)-2-[1-[3-[2-(2-methyl-4-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide
CID 159311926
2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
CID 8583685
N-(3-methoxyphenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 109029405
2-(3-methylphenyl)-N-[1-[3-(morpholine-4-carbonyl)phenyl]pyrazol-4-yl]acetamide
CID 117079181
methyl 3-[4-[(3-methylphenyl)carbamoylamino]pyrazol-1-yl]benzoate
CID 117076127
N-[3-(methoxymethyl)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 32639224
N-(2,5-dimethoxyphenyl)-3-[4-[[2-(3-methylphenyl)acetyl]amino]pyrazol-1-yl]benzamide;2,2,2-trifluoroacetate
CID 117074570
N-[2-(azepan-1-yl)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 38283400
ethane;N-(3-methylphenyl)-3-piperidin-1-ylpropanamide
CID 143383579
N-[2,5-dimethoxy-4-[[2-(1-phenylpyrazol-4-yl)acetyl]amino]phenyl]benzamide
CID 16614506
3-[4-[(3-methylphenyl)carbamoylamino]pyrazol-1-yl]benzamide
CID 117076261

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide (CID 158442288) is N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide is COc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCC5)nc4C)c3)c2)c1.COc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cnn(CCN5CCCCC5)c4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCC5)nc4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cn(CCN5CCCCC5)nc4C)c3)c2)c1.Cc1cccc(NC(=O)Cc2cnn(-c3cccc(C(=O)Cc4cnn(CCN5CCCC5)c4C)c3)c2)c1.Cc1nn(CCN2CCCCC2)cc1CC(=O)c1cccc(-n2cc(CC(=O)Nc3ccccc3F)cn2)c1.
What is the InChIKey of N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide?
The InChIKey is HCYVCQDTLGFRKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H36N6O3.C31H36N6O2.C30H33FN6O2.C30H34N6O3.2C30H34N6O2/c1-23-26(21-33-36(23)15-14-35-12-4-3-5-13-35)18-30(38)25-8-6-10-28(17-25)37-22-24(20-32-37)16-31(39)34-27-9-7-11-29(19-27)40-2;1-23-8-6-10-28(16-23)33-31(39)17-25-20-32-37(21-25)29-11-7-9-26(18-29)30(38)19-27-22-36(34-24(27)2)15-14-35-12-4-3-5-13-35;1-22-25(21-36(34-22)15-14-35-12-5-2-6-13-35)18-29(38)24-8-7-9-26(17-24)37-20-23(19-32-37)16-30(39)33-28-11-4-3-10-27(28)31;1-22-25(21-35(33-22)14-13-34-11-3-4-12-34)17-29(37)24-7-5-9-27(16-24)36-20-23(19-31-36)15-30(38)32-26-8-6-10-28(18-26)39-2;1-22-7-5-9-27(15-22)33-30(38)16-24-19-31-36(21-24)28-10-6-8-25(17-28)29(37)18-26-20-32-35(23(26)2)14-13-34-11-3-4-12-34;1-22-7-5-9-27(15-22)32-30(38)16-24-19-31-36(20-24)28-10-6-8-25(17-28)29(37)18-26-21-35(33-23(26)2)14-13-34-11-3-4-12-34/h6-11,17,19-22H,3-5,12-16,18H2,1-2H3,(H,34,39);6-11,16,18,20-22H,3-5,12-15,17,19H2,1-2H3,(H,33,39);3-4,7-11,17,19-21H,2,5-6,12-16,18H2,1H3,(H,33,39);5-10,16,18-21H,3-4,11-15,17H2,1-2H3,(H,32,38);5-10,15,17,19-21H,3-4,11-14,16,18H2,1-2H3,(H,33,38);5-10,15,17,19-21H,3-4,11-14,16,18H2,1-2H3,(H,32,38).
What are the key properties of N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide?
N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide has a molecular weight of 3141.89 g/mol, XLogP of 26.73, 62 rotatable bonds, 6 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[5-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methoxyphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-piperidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[3-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide;N-(3-methylphenyl)-2-[1-[3-[2-[5-methyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]acetyl]phenyl]pyrazol-4-yl]acetamide is sourced from PubChem (CID 158442288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).