6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide

C25H18ClN5O2 — CID 162672615

IUPAC6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide
SMILESCc1cccn(-c2ccc(-c3ccc4c(C(=O)Nc5ccncc5)n[nH]c4c3)c(Cl)c2)c1=O
InChIInChI=1S/C25H18ClN5O2/c1-15-3-2-12-31(25(15)33)18-5-7-19(21(26)14-18)16-4-6-20-22(13-16)29-30-23(20)24(32)28-17-8-10-27-11-9-17/h2-14H,1H3,(H,29,30)(H,27,28,32)
InChIKeyYICZAFSZFVMHTJ-UHFFFAOYSA-N
MW455.91 g/mol
LogP4.99
Rot. Bonds4

About 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide

6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide (PubChem CID 162672615) has the molecular formula C25H18ClN5O2 and a molecular weight of 455.91 g/mol. Its IUPAC name is 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide
PubChem CID162672615
Molecular FormulaC25H18ClN5O2
Molecular Weight455.91 g/mol
Exact Mass455.11
IUPAC Name6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide
SMILESCc1cccn(-c2ccc(-c3ccc4c(C(=O)Nc5ccncc5)n[nH]c4c3)c(Cl)c2)c1=O
InChIInChI=1S/C25H18ClN5O2/c1-15-3-2-12-31(25(15)33)18-5-7-19(21(26)14-18)16-4-6-20-22(13-16)29-30-23(20)24(32)28-17-8-10-27-11-9-17/h2-14H,1H3,(H,29,30)(H,27,28,32)
InChIKeyYICZAFSZFVMHTJ-UHFFFAOYSA-N
XLogP4.99
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500455.91
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-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 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide?
The IUPAC name of 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide (CID 162672615) is 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide.
What is the SMILES notation for 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide?
The canonical SMILES for 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide is Cc1cccn(-c2ccc(-c3ccc4c(C(=O)Nc5ccncc5)n[nH]c4c3)c(Cl)c2)c1=O.
What is the InChIKey of 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide?
The InChIKey is YICZAFSZFVMHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18ClN5O2/c1-15-3-2-12-31(25(15)33)18-5-7-19(21(26)14-18)16-4-6-20-22(13-16)29-30-23(20)24(32)28-17-8-10-27-11-9-17/h2-14H,1H3,(H,29,30)(H,27,28,32).
What are the key properties of 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide?
6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide has a molecular weight of 455.91 g/mol, XLogP of 4.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide is sourced from PubChem (CID 162672615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).