N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide

C15H9Cl2F3N4O2 — CID 24772512

IUPACN-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide
SMILESO=C(Nc1c(Cl)cncc1Cl)c1ccc(CO)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C15H9Cl2F3N4O2/c16-9-4-21-5-10(17)13(9)22-14(26)8-2-1-7(6-25)24-11(8)3-12(23-24)15(18,19)20/h1-5,25H,6H2,(H,21,22,26)
InChIKeyUFEHEJFNANDFOX-UHFFFAOYSA-N
MW405.16 g/mol
LogP3.80
Rot. Bonds3

About N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide

N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide (PubChem CID 24772512) has the molecular formula C15H9Cl2F3N4O2 and a molecular weight of 405.16 g/mol. Its IUPAC name is N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide
PubChem CID24772512
Molecular FormulaC15H9Cl2F3N4O2
Molecular Weight405.16 g/mol
Exact Mass404.01
IUPAC NameN-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide
SMILESO=C(Nc1c(Cl)cncc1Cl)c1ccc(CO)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C15H9Cl2F3N4O2/c16-9-4-21-5-10(17)13(9)22-14(26)8-2-1-7(6-25)24-11(8)3-12(23-24)15(18,19)20/h1-5,25H,6H2,(H,21,22,26)
InChIKeyUFEHEJFNANDFOX-UHFFFAOYSA-N
XLogP3.80
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.16
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
The IUPAC name of N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide (CID 24772512) is N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide.
What is the SMILES notation for N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
The canonical SMILES for N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide is O=C(Nc1c(Cl)cncc1Cl)c1ccc(CO)n2nc(C(F)(F)F)cc12.
What is the InChIKey of N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
The InChIKey is UFEHEJFNANDFOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2F3N4O2/c16-9-4-21-5-10(17)13(9)22-14(26)8-2-1-7(6-25)24-11(8)3-12(23-24)15(18,19)20/h1-5,25H,6H2,(H,21,22,26).
What are the key properties of N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide?
N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide has a molecular weight of 405.16 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-pyridinyl)-7-(hydroxymethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine-4-carboxamide is sourced from PubChem (CID 24772512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).