5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

C69H73N17O6 — CID 145092346

IUPAC5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
SMILESCC(=O)N1CCc2c(c(Nc3ccc(-c4ccc(C(=O)N5CCOCC5)cc4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4cncc(C#N)c4)cc3)nn2C)C1.CNC(=O)c1ccc(-c2ccc(Nc3nn(C)c4c3CN(C(C)=O)CC4)cc2)cn1
InChIInChI=1S/C26H29N5O3.C22H24N6O2.C21H20N6O/c1-18(32)31-12-11-24-23(17-31)25(28-29(24)2)27-22-9-7-20(8-10-22)19-3-5-21(6-4-19)26(33)30-13-15-34-16-14-30;1-14(29)28-11-10-20-18(13-28)21(26-27(20)3)25-17-7-4-15(5-8-17)16-6-9-19(24-12-16)22(30)23-2;1-14(28)27-8-7-20-19(13-27)21(25-26(20)2)24-18-5-3-16(4-6-18)17-9-15(10-22)11-23-12-17/h3-10H,11-17H2,1-2H3,(H,27,28);4-9,12H,10-11,13H2,1-3H3,(H,23,30)(H,25,26);3-6,9,11-12H,7-8,13H2,1-2H3,(H,24,25)
InChIKeyGKXMVFWNEVQYOB-UHFFFAOYSA-N
MW1236.46 g/mol
LogP8.70
Rot. Bonds11

About 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (PubChem CID 145092346) has the molecular formula C69H73N17O6 and a molecular weight of 1236.46 g/mol. Its IUPAC name is 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

Molecular Properties

Compound Name5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
PubChem CID145092346
Molecular FormulaC69H73N17O6
Molecular Weight1236.46 g/mol
Exact Mass1235.59
IUPAC Name5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
SMILESCC(=O)N1CCc2c(c(Nc3ccc(-c4ccc(C(=O)N5CCOCC5)cc4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4cncc(C#N)c4)cc3)nn2C)C1.CNC(=O)c1ccc(-c2ccc(Nc3nn(C)c4c3CN(C(C)=O)CC4)cc2)cn1
InChIInChI=1S/C26H29N5O3.C22H24N6O2.C21H20N6O/c1-18(32)31-12-11-24-23(17-31)25(28-29(24)2)27-22-9-7-20(8-10-22)19-3-5-21(6-4-19)26(33)30-13-15-34-16-14-30;1-14(29)28-11-10-20-18(13-28)21(26-27(20)3)25-17-7-4-15(5-8-17)16-6-9-19(24-12-16)22(30)23-2;1-14(28)27-8-7-20-19(13-27)21(25-26(20)2)24-18-5-3-16(4-6-18)17-9-15(10-22)11-23-12-17/h3-10H,11-17H2,1-2H3,(H,27,28);4-9,12H,10-11,13H2,1-3H3,(H,23,30)(H,25,26);3-6,9,11-12H,7-8,13H2,1-2H3,(H,24,25)
InChIKeyGKXMVFWNEVQYOB-UHFFFAOYSA-N
XLogP8.70
TPSA258.69 Ų
H-Bond Donors4
H-Bond Acceptors18
Rotatable Bonds11
Heavy Atoms92
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001236.46
LogP ≤ 58.70
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1018

Analyze 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone with MolForge

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Related Compounds

4-[4-amino-1-[(3R)-1-[(E)-2-cyano-4-methyl-4-[4-(oxetan-3-yl)piperazin-1-yl]pent-2-enoyl]piperidin-3-yl]pyrazolo[4,3-c]pyridin-3-yl]-N-pyridin-2-ylbenzamide
CID 124160762
4-[4-amino-1-[[(2S)-1-[(E)-2-cyano-4-methyl-4-[4-(oxetan-3-yl)piperazin-1-yl]pent-2-enoyl]pyrrolidin-2-yl]methyl]pyrazolo[4,3-c]pyridin-3-yl]-N-pyridin-2-ylbenzamide
CID 124160883
US10023570, Example 358
CID 126740182
US10023570, Example 363
CID 126740476
4-[4-amino-1-[[(2S)-1-[(E)-2-cyano-4-methyl-4-morpholin-4-ylpent-2-enoyl]pyrrolidin-2-yl]methyl]pyrazolo[4,3-c]pyridin-3-yl]-N-pyridin-2-ylbenzamide
CID 162678071
1-Methyl-3-[4-[4-morpholin-4-yl-1-[1-[3-(trifluoromethyl)benzoyl]piperidin-4-yl]pyrazolo[5,4-d]pyrimidin-6-yl]phenyl]urea;1-[4-[4-morpholin-4-yl-1-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[5,4-d]pyrimidin-6-yl]phenyl]-3-phenylurea
CID 87606159
N-[3-[2-[1-[2-[2-[2-[3,5-dimethyl-1-[[2-(2-morpholin-4-yl-6-piperazin-1-yl-4-pyridinyl)-4-[[2-(trifluoromethyl)pyridine-4-carbonyl]amino]phenyl]methyl]pyrazol-4-yl]-6-morpholin-4-yl-4-pyridinyl]-4-[[2-(trifluoromethyl)pyridine-4-carbonyl]amino]phenyl]ethyl]pyrazol-4-yl]-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 130425732
1-[4-[1-(2-hydroxyethyl)pyrazolo[3,4-b]pyridin-4-yl]phenyl]-3-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]urea;1-[3-methyl-4-[(4-methylpiperazin-1-yl)methyl]phenyl]-3-[4-(1-methylpyrazolo[3,4-b]pyridin-4-yl)phenyl]urea;N,N,1-trimethyl-4-[4-[[3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazolo[5,4-b]pyridine-6-carboxamide
CID 158803740
6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide
CID 159030856
N-[5-[5-cyano-6-(dimethylamino)-3-pyridinyl]-6-methyl-3-pyridinyl]-1,3-dimethylpyrazole-4-carboxamide;N-[5-[5-cyano-6-(dimethylamino)-3-pyridinyl]-6-methyl-3-pyridinyl]-2,5-dimethylpyrazole-3-carboxamide;N-[5-[5-cyano-6-(dimethylamino)-3-pyridinyl]-6-methyl-3-pyridinyl]-1-ethyl-3-methylpyrazole-4-carboxamide;N-[3-[5-cyano-6-(2-methoxyethylamino)-3-pyridinyl]-4-methylphenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[5-[5-cyano-6-(2-methoxyethylamino)-3-pyridinyl]-6-methyl-3-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[5-(5-cyano-6-morpholin-4-yl-3-pyridinyl)-6-methyl-3-pyridinyl]-4-(2-cyanopropan-2-yl)pyridine-2-carboxamide
CID 161076767
N-(4-cyanophenyl)-5-[5-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethyl-methylamino]-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;methane;5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 161974557
3-[7-[[4-[2-[4-[5-acetyl-3-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]piperidin-1-yl]ethyl]morpholin-2-yl]methylamino]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
CID 171399426

Frequently Asked Questions

What is the IUPAC name of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
The IUPAC name of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (CID 145092346) is 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.
What is the SMILES notation for 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
The canonical SMILES for 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is CC(=O)N1CCc2c(c(Nc3ccc(-c4ccc(C(=O)N5CCOCC5)cc4)cc3)nn2C)C1.CC(=O)N1CCc2c(c(Nc3ccc(-c4cncc(C#N)c4)cc3)nn2C)C1.CNC(=O)c1ccc(-c2ccc(Nc3nn(C)c4c3CN(C(C)=O)CC4)cc2)cn1.
What is the InChIKey of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
The InChIKey is GKXMVFWNEVQYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N5O3.C22H24N6O2.C21H20N6O/c1-18(32)31-12-11-24-23(17-31)25(28-29(24)2)27-22-9-7-20(8-10-22)19-3-5-21(6-4-19)26(33)30-13-15-34-16-14-30;1-14(29)28-11-10-20-18(13-28)21(26-27(20)3)25-17-7-4-15(5-8-17)16-6-9-19(24-12-16)22(30)23-2;1-14(28)27-8-7-20-19(13-27)21(25-26(20)2)24-18-5-3-16(4-6-18)17-9-15(10-22)11-23-12-17/h3-10H,11-17H2,1-2H3,(H,27,28);4-9,12H,10-11,13H2,1-3H3,(H,23,30)(H,25,26);3-6,9,11-12H,7-8,13H2,1-2H3,(H,24,25).
What are the key properties of 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone has a molecular weight of 1236.46 g/mol, XLogP of 8.70, 11 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]-N-methylpyridine-2-carboxamide;5-[4-[(5-acetyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)amino]phenyl]pyridine-3-carbonitrile;1-[1-methyl-3-[4-[4-(morpholine-4-carbonyl)phenyl]anilino]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is sourced from PubChem (CID 145092346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).