N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide

C19H21F3N6O — CID 139431459

IUPACN-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide
SMILESCN1CCC(NC(=O)c2n[nH]c3ccc(-c4cc(C(F)(F)F)nn4C)cc23)CC1
InChIInChI=1S/C19H21F3N6O/c1-27-7-5-12(6-8-27)23-18(29)17-13-9-11(3-4-14(13)24-25-17)15-10-16(19(20,21)22)26-28(15)2/h3-4,9-10,12H,5-8H2,1-2H3,(H,23,29)(H,24,25)
InChIKeyMFCXTSXNFOLGOK-UHFFFAOYSA-N
MW406.41 g/mol
LogP2.81
Rot. Bonds3

About N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide

N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide (PubChem CID 139431459) has the molecular formula C19H21F3N6O and a molecular weight of 406.41 g/mol. Its IUPAC name is N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide
PubChem CID139431459
Molecular FormulaC19H21F3N6O
Molecular Weight406.41 g/mol
Exact Mass406.17
IUPAC NameN-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide
SMILESCN1CCC(NC(=O)c2n[nH]c3ccc(-c4cc(C(F)(F)F)nn4C)cc23)CC1
InChIInChI=1S/C19H21F3N6O/c1-27-7-5-12(6-8-27)23-18(29)17-13-9-11(3-4-14(13)24-25-17)15-10-16(19(20,21)22)26-28(15)2/h3-4,9-10,12H,5-8H2,1-2H3,(H,23,29)(H,24,25)
InChIKeyMFCXTSXNFOLGOK-UHFFFAOYSA-N
XLogP2.81
TPSA78.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.41
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-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

5-(1-aminoisoquinolin-7-yl)-N-(1-methylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 171446132
5-(2,3-dimethylimidazol-4-yl)-N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-1H-indazole-3-carboxamide
CID 139431435
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-5-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide
CID 67273538
5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 118382368
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(1-methylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 118382158
5-(5-amino-3-pyridinyl)-N-(1-tert-butylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 118382151
N-cyclopentyl-5-(1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 160652856
1-[4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-3-[(3S)-pyrrolidin-3-yl]urea
CID 126440780
N-cyclopropyl-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 19477474
1-methyl-N-pyrrolidin-3-yl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 156608717
5-amino-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1H-indazole-3-carboxamide
CID 11659418
N-(1-butylpiperidin-4-yl)-5-chloro-1H-indazole-3-carboxamide
CID 138995778

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide?
The IUPAC name of N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide (CID 139431459) is N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide is CN1CCC(NC(=O)c2n[nH]c3ccc(-c4cc(C(F)(F)F)nn4C)cc23)CC1.
What is the InChIKey of N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide?
The InChIKey is MFCXTSXNFOLGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F3N6O/c1-27-7-5-12(6-8-27)23-18(29)17-13-9-11(3-4-14(13)24-25-17)15-10-16(19(20,21)22)26-28(15)2/h3-4,9-10,12H,5-8H2,1-2H3,(H,23,29)(H,24,25).
What are the key properties of N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide?
N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide has a molecular weight of 406.41 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-4-yl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 139431459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).