N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide

C23H19F2N3O — CID 10340398

IUPACN-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCc1cc(Cc2ccc(F)c(F)c2)cn2nc(C(=O)NCc3ccccc3)cc12
InChIInChI=1S/C23H19F2N3O/c1-15-9-18(10-17-7-8-19(24)20(25)11-17)14-28-22(15)12-21(27-28)23(29)26-13-16-5-3-2-4-6-16/h2-9,11-12,14H,10,13H2,1H3,(H,26,29)
InChIKeyQDURBYDRAOMWHD-UHFFFAOYSA-N
MW391.42 g/mol
LogP4.44
Rot. Bonds5

About N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide

N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 10340398) has the molecular formula C23H19F2N3O and a molecular weight of 391.42 g/mol. Its IUPAC name is N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide
PubChem CID10340398
Molecular FormulaC23H19F2N3O
Molecular Weight391.42 g/mol
Exact Mass391.15
IUPAC NameN-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCc1cc(Cc2ccc(F)c(F)c2)cn2nc(C(=O)NCc3ccccc3)cc12
InChIInChI=1S/C23H19F2N3O/c1-15-9-18(10-17-7-8-19(24)20(25)11-17)14-28-22(15)12-21(27-28)23(29)26-13-16-5-3-2-4-6-16/h2-9,11-12,14H,10,13H2,1H3,(H,26,29)
InChIKeyQDURBYDRAOMWHD-UHFFFAOYSA-N
XLogP4.44
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide?
The IUPAC name of N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide (CID 10340398) is N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide?
The canonical SMILES for N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide is Cc1cc(Cc2ccc(F)c(F)c2)cn2nc(C(=O)NCc3ccccc3)cc12.
What is the InChIKey of N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide?
The InChIKey is QDURBYDRAOMWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19F2N3O/c1-15-9-18(10-17-7-8-19(24)20(25)11-17)14-28-22(15)12-21(27-28)23(29)26-13-16-5-3-2-4-6-16/h2-9,11-12,14H,10,13H2,1H3,(H,26,29).
What are the key properties of N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide?
N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 391.42 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-[(3,4-difluorophenyl)methyl]-4-methylpyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 10340398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).