N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide

C23H18FN7O2 — CID 90383104

IUPACN-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide
SMILESCOc1cccnc1-c1cnn(C)c1C(=O)Nc1cc2nc(-c3ccccc3)nn2cc1F
InChIInChI=1S/C23H18FN7O2/c1-30-21(15(12-26-30)20-18(33-2)9-6-10-25-20)23(32)27-17-11-19-28-22(14-7-4-3-5-8-14)29-31(19)13-16(17)24/h3-13H,1-2H3,(H,27,32)
InChIKeyMQLASWXQQSJHCN-UHFFFAOYSA-N
MW443.44 g/mol
LogP3.59
Rot. Bonds5

About N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide

N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide (PubChem CID 90383104) has the molecular formula C23H18FN7O2 and a molecular weight of 443.44 g/mol. Its IUPAC name is N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide
PubChem CID90383104
Molecular FormulaC23H18FN7O2
Molecular Weight443.44 g/mol
Exact Mass443.15
IUPAC NameN-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide
SMILESCOc1cccnc1-c1cnn(C)c1C(=O)Nc1cc2nc(-c3ccccc3)nn2cc1F
InChIInChI=1S/C23H18FN7O2/c1-30-21(15(12-26-30)20-18(33-2)9-6-10-25-20)23(32)27-17-11-19-28-22(14-7-4-3-5-8-14)29-31(19)13-16(17)24/h3-13H,1-2H3,(H,27,32)
InChIKeyMQLASWXQQSJHCN-UHFFFAOYSA-N
XLogP3.59
TPSA99.23 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.44
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide 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 N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide?
The IUPAC name of N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide (CID 90383104) is N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide?
The canonical SMILES for N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide is COc1cccnc1-c1cnn(C)c1C(=O)Nc1cc2nc(-c3ccccc3)nn2cc1F.
What is the InChIKey of N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide?
The InChIKey is MQLASWXQQSJHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN7O2/c1-30-21(15(12-26-30)20-18(33-2)9-6-10-25-20)23(32)27-17-11-19-28-22(14-7-4-3-5-8-14)29-31(19)13-16(17)24/h3-13H,1-2H3,(H,27,32).
What are the key properties of N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide?
N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide has a molecular weight of 443.44 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-methoxy-2-pyridinyl)-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 90383104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).