5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide

C96H80F18N12O6 — CID 159399355

IUPAC5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide
SMILESC=C1CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1.CC1=CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1.CC1CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1
InChIInChI=1S/C32H28F6N4O2.2C32H26F6N4O2/c3*1-17-4-2-6-27-28(17)30(32(36,37)38)41-42(27)16-23(43)13-20(10-18-11-21(33)15-22(34)12-18)29-24(5-3-9-40-29)19-7-8-26(35)25(14-19)31(39)44/h3,5,7-9,11-12,14-15,17,20H,2,4,6,10,13,16H2,1H3,(H2,39,44);3-5,7-9,11-12,14-15,20H,2,6,10,13,16H2,1H3,(H2,39,44);3,5,7-9,11-12,14-15,20H,1-2,4,6,10,13,16H2,(H2,39,44)/t17?,20-;2*20-/m111/s1
InChIKeyLNDIIZUVYBGRGA-KGAANVCESA-N
MW1839.74 g/mol
LogP20.54
Rot. Bonds27

About 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide

5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide (PubChem CID 159399355) has the molecular formula C96H80F18N12O6 and a molecular weight of 1839.74 g/mol. Its IUPAC name is 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide.

Molecular Properties

Compound Name5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide
PubChem CID159399355
Molecular FormulaC96H80F18N12O6
Molecular Weight1839.74 g/mol
Exact Mass1838.60
IUPAC Name5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide
SMILESC=C1CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1.CC1=CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1.CC1CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1
InChIInChI=1S/C32H28F6N4O2.2C32H26F6N4O2/c3*1-17-4-2-6-27-28(17)30(32(36,37)38)41-42(27)16-23(43)13-20(10-18-11-21(33)15-22(34)12-18)29-24(5-3-9-40-29)19-7-8-26(35)25(14-19)31(39)44/h3,5,7-9,11-12,14-15,17,20H,2,4,6,10,13,16H2,1H3,(H2,39,44);3-5,7-9,11-12,14-15,20H,2,6,10,13,16H2,1H3,(H2,39,44);3,5,7-9,11-12,14-15,20H,1-2,4,6,10,13,16H2,(H2,39,44)/t17?,20-;2*20-/m111/s1
InChIKeyLNDIIZUVYBGRGA-KGAANVCESA-N
XLogP20.54
TPSA272.61 Ų
H-Bond Donors3
H-Bond Acceptors15
Rotatable Bonds27
Heavy Atoms132
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001839.74
LogP ≤ 520.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1015

Analyze 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide 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

5-[2-(3-Fluorophenyl)piperidin-1-yl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-[2-(trifluoromethyl)phenyl]pyrrolidin-1-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 68282607
(S)-N-(1-(3,5-bis(3-oxoisoindolin-5-yl)pyridin-2-yl)-2-(3,5-difluorophenyl)ethyl)-2-(3-(difluoromethyl)-4,4,7,7-tetrafluoro-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetamide
CID 78320759
(S)-5-(2-(2-(3,5-difluorophenyl)-1-(2-(5-oxo-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetamido)ethyl)pyridin-3-yl)-2-fluorobenzamide
CID 86719871
5-[2-[2-(3,5-difluorophenyl)-2-[[2-[5-oxo-3-(trifluoromethyl)-6,7-dihydro-4H-indazol-1-yl]acetyl]amino]ethyl]-3-pyridinyl]-2-fluorobenzamide
CID 89350675
5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[2-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetyl]amino]ethyl]pyridin-3-yl]-2-fluorobenzamide
CID 89351097
5-[2-[2-(3,5-difluorophenyl)-1-[[2-[5-oxo-3-(trifluoromethyl)-6,7-dihydro-4H-indazol-1-yl]acetyl]amino]ethyl]pyridin-3-yl]-2-fluorobenzamide
CID 90150427
2-[3-(difluoromethyl)-4,4,7,7-tetrafluoro-5,6-dihydroindazol-1-yl]-N-[(1S)-2-(3,5-difluorophenyl)-1-[3-(2-methyl-1-oxo-3H-isoindol-5-yl)-2-pyridinyl]ethyl]acetamide
CID 90162581
(S)-5-(2-(1-(2-(3-(difluoromethyl)-4,4,7,7-tetrafluoro-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetamido)-2-(3,5-difluorophenyl)ethyl)-5-(1,3-dioxoisoindolin-2-yl)pyridin-3-yl)-2-fluorobenzamide
CID 90281315
5-[2-[1-[[2-[3-(Difluoromethyl)-4,4,7,7-tetrafluoro-5,6-dihydroindazol-1-yl]acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-5-(1,3-dioxoisoindol-2-yl)pyridin-3-yl]-2-fluorobenzamide
CID 90281316
N-[1-[3,5-bis(3-oxo-1,2-dihydroisoindol-5-yl)-2-pyridinyl]-2-(3,5-difluorophenyl)ethyl]-2-[3-(difluoromethyl)-4,4,7,7-tetrafluoro-5,6-dihydroindazol-1-yl]acetamide
CID 117600308
N-[1-[3-(3-acetylphenyl)-2-pyridinyl]-2-(3,5-difluorophenyl)ethyl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamide
CID 123610241
5-[2-[2-(3,5-Difluorophenyl)-1-[[2-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetyl]amino]ethyl]pyridin-3-yl]-2-fluorobenzamide
CID 123720146

Frequently Asked Questions

What is the IUPAC name of 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide?
The IUPAC name of 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide (CID 159399355) is 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide.
What is the SMILES notation for 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide?
The canonical SMILES for 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide is C=C1CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1.CC1=CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1.CC1CCCc2c1c(C(F)(F)F)nn2CC(=O)C[C@@H](Cc1cc(F)cc(F)c1)c1ncccc1-c1ccc(F)c(C(N)=O)c1.
What is the InChIKey of 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide?
The InChIKey is LNDIIZUVYBGRGA-KGAANVCESA-N. The full InChI is InChI=1S/C32H28F6N4O2.2C32H26F6N4O2/c3*1-17-4-2-6-27-28(17)30(32(36,37)38)41-42(27)16-23(43)13-20(10-18-11-21(33)15-22(34)12-18)29-24(5-3-9-40-29)19-7-8-26(35)25(14-19)31(39)44/h3,5,7-9,11-12,14-15,17,20H,2,4,6,10,13,16H2,1H3,(H2,39,44);3-5,7-9,11-12,14-15,20H,2,6,10,13,16H2,1H3,(H2,39,44);3,5,7-9,11-12,14-15,20H,1-2,4,6,10,13,16H2,(H2,39,44)/t17?,20-;2*20-/m111/s1.
What are the key properties of 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide?
5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide has a molecular weight of 1839.74 g/mol, XLogP of 20.54, 27 rotatable bonds, 3 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methylidene-3-(trifluoromethyl)-6,7-dihydro-5H-indazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-6,7-dihydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide;5-[2-[(2R)-1-(3,5-difluorophenyl)-5-[4-methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]-4-oxopentan-2-yl]-3-pyridinyl]-2-fluorobenzamide is sourced from PubChem (CID 159399355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).