N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide

C19H11ClF3N9O — CID 134609756

IUPACN-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide
SMILESO=C(Nc1cnc(-n2nccn2)c(Cl)c1)c1cnn(-c2cccc3cncn23)c1C(F)(F)F
InChIInChI=1S/C19H11ClF3N9O/c20-14-6-11(7-25-17(14)32-26-4-5-27-32)29-18(33)13-9-28-31(16(13)19(21,22)23)15-3-1-2-12-8-24-10-30(12)15/h1-10H,(H,29,33)
InChIKeyCMTHLSRKTLYACC-UHFFFAOYSA-N
MW473.81 g/mol
LogP3.42
Rot. Bonds4

About N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide

N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide (PubChem CID 134609756) has the molecular formula C19H11ClF3N9O and a molecular weight of 473.81 g/mol. Its IUPAC name is N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide
PubChem CID134609756
Molecular FormulaC19H11ClF3N9O
Molecular Weight473.81 g/mol
Exact Mass473.07
IUPAC NameN-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide
SMILESO=C(Nc1cnc(-n2nccn2)c(Cl)c1)c1cnn(-c2cccc3cncn23)c1C(F)(F)F
InChIInChI=1S/C19H11ClF3N9O/c20-14-6-11(7-25-17(14)32-26-4-5-27-32)29-18(33)13-9-28-31(16(13)19(21,22)23)15-3-1-2-12-8-24-10-30(12)15/h1-10H,(H,29,33)
InChIKeyCMTHLSRKTLYACC-UHFFFAOYSA-N
XLogP3.42
TPSA107.82 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.81
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-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-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide?
The IUPAC name of N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide (CID 134609756) is N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide.
What is the SMILES notation for N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide?
The canonical SMILES for N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide is O=C(Nc1cnc(-n2nccn2)c(Cl)c1)c1cnn(-c2cccc3cncn23)c1C(F)(F)F.
What is the InChIKey of N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide?
The InChIKey is CMTHLSRKTLYACC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11ClF3N9O/c20-14-6-11(7-25-17(14)32-26-4-5-27-32)29-18(33)13-9-28-31(16(13)19(21,22)23)15-3-1-2-12-8-24-10-30(12)15/h1-10H,(H,29,33).
What are the key properties of N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide?
N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide has a molecular weight of 473.81 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-6-(triazol-2-yl)-3-pyridinyl]-1-imidazo[1,5-a]pyridin-5-yl-5-(trifluoromethyl)pyrazole-4-carboxamide is sourced from PubChem (CID 134609756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).