N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide

C23H24F2N4O — CID 118382103

IUPACN-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide
SMILESO=C(NC1CC1)c1n[nH]c2ccc(-c3cc(CN4CCCCC4)cc(F)c3F)cc12
InChIInChI=1S/C23H24F2N4O/c24-19-11-14(13-29-8-2-1-3-9-29)10-17(21(19)25)15-4-7-20-18(12-15)22(28-27-20)23(30)26-16-5-6-16/h4,7,10-12,16H,1-3,5-6,8-9,13H2,(H,26,30)(H,27,28)
InChIKeyPTULMTAEADHJBL-UHFFFAOYSA-N
MW410.47 g/mol
LogP4.39
Rot. Bonds5

About N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide

N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide (PubChem CID 118382103) has the molecular formula C23H24F2N4O and a molecular weight of 410.47 g/mol. Its IUPAC name is N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide
PubChem CID118382103
Molecular FormulaC23H24F2N4O
Molecular Weight410.47 g/mol
Exact Mass410.19
IUPAC NameN-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide
SMILESO=C(NC1CC1)c1n[nH]c2ccc(-c3cc(CN4CCCCC4)cc(F)c3F)cc12
InChIInChI=1S/C23H24F2N4O/c24-19-11-14(13-29-8-2-1-3-9-29)10-17(21(19)25)15-4-7-20-18(12-15)22(28-27-20)23(30)26-16-5-6-16/h4,7,10-12,16H,1-3,5-6,8-9,13H2,(H,26,30)(H,27,28)
InChIKeyPTULMTAEADHJBL-UHFFFAOYSA-N
XLogP4.39
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.47
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-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-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-N-(3-methyl-2-pyridinyl)-1H-indazole-3-carboxamide
CID 118390932
5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-N-[3-(trifluoromethyl)-2-pyridinyl]-1H-indazole-3-carboxamide
CID 118382148
N-(cyclobutylmethyl)-1-[5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazol-3-yl]ethenamine;ethane
CID 144928975
5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-N-[6-(pentan-3-ylcarbamoyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381702
5-[5-(azepan-1-ylmethyl)-3-pyridinyl]-N-(oxan-4-yl)-1H-indazole-3-carboxamide
CID 118381641
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-(1-propan-2-ylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 118381779
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-(1-prop-2-ynylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 118381541
N-cyclopropyl-5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381128
N-cyclohexyl-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382226
N-cyclohexyl-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382016
5-[3-fluoro-5-(piperidin-1-ylmethyl)-2-prop-1-en-2-ylphenyl]-N-(5-fluoro-2-pyridinyl)-1H-indazole-3-carboxamide
CID 144929278
3-N-[1-[5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazol-3-yl]ethenyl]-1-N-(2,2-dimethylpropyl)-1-N-methylpentane-1,3-diamine
CID 144928879

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide (CID 118382103) is N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide is O=C(NC1CC1)c1n[nH]c2ccc(-c3cc(CN4CCCCC4)cc(F)c3F)cc12.
What is the InChIKey of N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide?
The InChIKey is PTULMTAEADHJBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24F2N4O/c24-19-11-14(13-29-8-2-1-3-9-29)10-17(21(19)25)15-4-7-20-18(12-15)22(28-27-20)23(30)26-16-5-6-16/h4,7,10-12,16H,1-3,5-6,8-9,13H2,(H,26,30)(H,27,28).
What are the key properties of N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide?
N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide has a molecular weight of 410.47 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[2,3-difluoro-5-(piperidin-1-ylmethyl)phenyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 118382103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).