N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide

C18H14FN5O2 — CID 54589158

IUPACN-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCc1noc(C)c1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C18H14FN5O2/c1-10-17(11(2)26-23-10)22-18(25)15-7-20-9-16-14(15)8-21-24(16)13-5-3-12(19)4-6-13/h3-9H,1-2H3,(H,22,25)
InChIKeyMAFFNNFAESPUDK-UHFFFAOYSA-N
MW351.34 g/mol
LogP3.42
Rot. Bonds3

About N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide

N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide (PubChem CID 54589158) has the molecular formula C18H14FN5O2 and a molecular weight of 351.34 g/mol. Its IUPAC name is N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide
PubChem CID54589158
Molecular FormulaC18H14FN5O2
Molecular Weight351.34 g/mol
Exact Mass351.11
IUPAC NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCc1noc(C)c1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C18H14FN5O2/c1-10-17(11(2)26-23-10)22-18(25)15-7-20-9-16-14(15)8-21-24(16)13-5-3-12(19)4-6-13/h3-9H,1-2H3,(H,22,25)
InChIKeyMAFFNNFAESPUDK-UHFFFAOYSA-N
XLogP3.42
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.34
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide?
The IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide (CID 54589158) is N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide.
What is the SMILES notation for N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide?
The canonical SMILES for N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide is Cc1noc(C)c1NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1.
What is the InChIKey of N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide?
The InChIKey is MAFFNNFAESPUDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN5O2/c1-10-17(11(2)26-23-10)22-18(25)15-7-20-9-16-14(15)8-21-24(16)13-5-3-12(19)4-6-13/h3-9H,1-2H3,(H,22,25).
What are the key properties of N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide?
N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide has a molecular weight of 351.34 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 54589158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).