2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide

C19H19F4N5O2 — CID 90119026

IUPAC2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide
SMILESCC(C)C(=O)Nc1nccc2nn(Cc3ccc(OCC(F)(F)C(F)F)cn3)cc12
InChIInChI=1S/C19H19F4N5O2/c1-11(2)17(29)26-16-14-9-28(27-15(14)5-6-24-16)8-12-3-4-13(7-25-12)30-10-19(22,23)18(20)21/h3-7,9,11,18H,8,10H2,1-2H3,(H,24,26,29)
InChIKeyQUTQMINPBIAIMJ-UHFFFAOYSA-N
MW425.39 g/mol
LogP3.75
Rot. Bonds8

About 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide

2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide (PubChem CID 90119026) has the molecular formula C19H19F4N5O2 and a molecular weight of 425.39 g/mol. Its IUPAC name is 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide
PubChem CID90119026
Molecular FormulaC19H19F4N5O2
Molecular Weight425.39 g/mol
Exact Mass425.15
IUPAC Name2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide
SMILESCC(C)C(=O)Nc1nccc2nn(Cc3ccc(OCC(F)(F)C(F)F)cn3)cc12
InChIInChI=1S/C19H19F4N5O2/c1-11(2)17(29)26-16-14-9-28(27-15(14)5-6-24-16)8-12-3-4-13(7-25-12)30-10-19(22,23)18(20)21/h3-7,9,11,18H,8,10H2,1-2H3,(H,24,26,29)
InChIKeyQUTQMINPBIAIMJ-UHFFFAOYSA-N
XLogP3.75
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.39
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide?
The IUPAC name of 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide (CID 90119026) is 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide?
The canonical SMILES for 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide is CC(C)C(=O)Nc1nccc2nn(Cc3ccc(OCC(F)(F)C(F)F)cn3)cc12.
What is the InChIKey of 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide?
The InChIKey is QUTQMINPBIAIMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F4N5O2/c1-11(2)17(29)26-16-14-9-28(27-15(14)5-6-24-16)8-12-3-4-13(7-25-12)30-10-19(22,23)18(20)21/h3-7,9,11,18H,8,10H2,1-2H3,(H,24,26,29).
What are the key properties of 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide?
2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide has a molecular weight of 425.39 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide is sourced from PubChem (CID 90119026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).