N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C23H18FN7O — CID 171656019

IUPACN-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2nnn(Cc3ccccc3F)n2)cc1NC(=O)c1cnn2ccccc12
InChIInChI=1S/C23H18FN7O/c1-15-9-10-16(22-27-29-31(28-22)14-17-6-2-3-7-19(17)24)12-20(15)26-23(32)18-13-25-30-11-5-4-8-21(18)30/h2-13H,14H2,1H3,(H,26,32)
InChIKeyYNYLXGPQEXBFDD-UHFFFAOYSA-N
MW427.44 g/mol
LogP3.74
Rot. Bonds5

About N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 171656019) has the molecular formula C23H18FN7O and a molecular weight of 427.44 g/mol. Its IUPAC name is N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID171656019
Molecular FormulaC23H18FN7O
Molecular Weight427.44 g/mol
Exact Mass427.16
IUPAC NameN-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2nnn(Cc3ccccc3F)n2)cc1NC(=O)c1cnn2ccccc12
InChIInChI=1S/C23H18FN7O/c1-15-9-10-16(22-27-29-31(28-22)14-17-6-2-3-7-19(17)24)12-20(15)26-23(32)18-13-25-30-11-5-4-8-21(18)30/h2-13H,14H2,1H3,(H,26,32)
InChIKeyYNYLXGPQEXBFDD-UHFFFAOYSA-N
XLogP3.74
TPSA90.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.44
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-methyl-3-(1-methyl-6-(pyridin-3-yl)-1H-pyrazolo(3,4-d)pyrimidin-4-ylamino)-N-(3-(trifluoromethyl)phenyl)benzamide
CID 16747388
4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxamide
CID 11531982
6-{3-amino-1-[3-(1H-indol-6-yl)phenyl]-1H-pyrazol-4-yl}-3,4-dihydroisoquinolin-1(2H)-one
CID 44593854
N-(2,3-dimethylphenyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 16193945
N-(3-fluoro-4-pyridinyl)-2-phenylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 165415060
3-[[1-(2-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-N,4-dimethylbenzamide
CID 23400159
3-[[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-N,4-dimethylbenzamide
CID 23400164
4-Methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide
CID 23400177
N-butyl-4-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide
CID 23400224
(2-((1H-indazol-6-yl)methylamino)phenyl)(5-fluoro-1H-indol-3-yl)methanone
CID 44577987
(2-((1H-indazol-6-yl)methylamino)phenyl)(6-fluoro-1H-indol-3-yl)methanone
CID 44577988
2-(4-(pyridin-4-ylcarbamoyl)phenyl)-2H-indazole-7-carboxamide
CID 46226284

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 171656019) is N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1ccc(-c2nnn(Cc3ccccc3F)n2)cc1NC(=O)c1cnn2ccccc12.
What is the InChIKey of N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is YNYLXGPQEXBFDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN7O/c1-15-9-10-16(22-27-29-31(28-22)14-17-6-2-3-7-19(17)24)12-20(15)26-23(32)18-13-25-30-11-5-4-8-21(18)30/h2-13H,14H2,1H3,(H,26,32).
What are the key properties of N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 427.44 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-[(2-fluorophenyl)methyl]tetrazol-5-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 171656019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).