5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide

C25H25F3N6O2 — CID 155601144

IUPAC5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide
SMILESNC(=O)c1n[nH]c2ccc(-c3cnn(C4CCN(CCF)CC4c4ccc(OC(F)F)cc4)c3)cc12
InChIInChI=1S/C25H25F3N6O2/c26-8-10-33-9-7-22(20(14-33)15-1-4-18(5-2-15)36-25(27)28)34-13-17(12-30-34)16-3-6-21-19(11-16)23(24(29)35)32-31-21/h1-6,11-13,20,22,25H,7-10,14H2,(H2,29,35)(H,31,32)
InChIKeyCEUQMVZIHZUNAQ-UHFFFAOYSA-N
MW498.51 g/mol
LogP4.13
Rot. Bonds8

About 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide

5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide (PubChem CID 155601144) has the molecular formula C25H25F3N6O2 and a molecular weight of 498.51 g/mol. Its IUPAC name is 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide
PubChem CID155601144
Molecular FormulaC25H25F3N6O2
Molecular Weight498.51 g/mol
Exact Mass498.20
IUPAC Name5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide
SMILESNC(=O)c1n[nH]c2ccc(-c3cnn(C4CCN(CCF)CC4c4ccc(OC(F)F)cc4)c3)cc12
InChIInChI=1S/C25H25F3N6O2/c26-8-10-33-9-7-22(20(14-33)15-1-4-18(5-2-15)36-25(27)28)34-13-17(12-30-34)16-3-6-21-19(11-16)23(24(29)35)32-31-21/h1-6,11-13,20,22,25H,7-10,14H2,(H2,29,35)(H,31,32)
InChIKeyCEUQMVZIHZUNAQ-UHFFFAOYSA-N
XLogP4.13
TPSA102.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.51
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-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

[(3S)-1-azabicyclo[2.2.2]octan-3-yl] 5-(difluoromethoxy)-1H-indazole-3-carboxylate
CID 11667210
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381235
N-cyclopentyl-5-(1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 160652856
N-[(2S)-3,3-difluorobutan-2-yl]-5-(1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 158269993
N-(2,2-difluoro-3-pyrrolidin-1-ylpropyl)-5-(1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 139431447
N-[4-(difluoromethoxy)phenyl]-5-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-1H-indazole-3-carboxamide
CID 139431508
5-(difluoromethoxy)-1H-indazole-3-carboxylic acid;5-(difluoromethoxy)-3-iodo-2H-indazole
CID 157399877
5-fluoro-N-[1-[5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazol-3-yl]ethenyl]pyridin-3-amine
CID 139448859
2-methyl-N-[1-[5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazol-3-yl]ethenyl]-1,3-thiazol-5-amine
CID 139448880
3-[4-(3-amino-1H-indazol-5-yl)pyrazol-1-yl]butanoic acid
CID 68797274
N-[4-(1-fluoroethoxy)phenyl]-5-[1-(oxan-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-[1-(piperidin-4-ylmethyl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-methylpiperidin-4-yl)phenyl]-5-(1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 167622647
N-[(4,4-difluorocyclohexyl)methyl]-1-[5-(1-methylpyrazol-4-yl)-1H-indazol-3-yl]ethenamine
CID 139448823

Frequently Asked Questions

What is the IUPAC name of 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide?
The IUPAC name of 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide (CID 155601144) is 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide?
The canonical SMILES for 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide is NC(=O)c1n[nH]c2ccc(-c3cnn(C4CCN(CCF)CC4c4ccc(OC(F)F)cc4)c3)cc12.
What is the InChIKey of 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide?
The InChIKey is CEUQMVZIHZUNAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25F3N6O2/c26-8-10-33-9-7-22(20(14-33)15-1-4-18(5-2-15)36-25(27)28)34-13-17(12-30-34)16-3-6-21-19(11-16)23(24(29)35)32-31-21/h1-6,11-13,20,22,25H,7-10,14H2,(H2,29,35)(H,31,32).
What are the key properties of 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide?
5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide has a molecular weight of 498.51 g/mol, XLogP of 4.13, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[3-[4-(difluoromethoxy)phenyl]-1-(2-fluoroethyl)piperidin-4-yl]pyrazol-4-yl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 155601144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).