2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide

C18H12ClN7O — CID 164587264

IUPAC2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide
SMILESCn1cc(-n2ncc3ccc(NC(=O)c4cc(C#N)cnc4Cl)cc32)cn1
InChIInChI=1S/C18H12ClN7O/c1-25-10-14(9-22-25)26-16-5-13(3-2-12(16)8-23-26)24-18(27)15-4-11(6-20)7-21-17(15)19/h2-5,7-10H,1H3,(H,24,27)
InChIKeyTUOXUWSVDIKEPB-UHFFFAOYSA-N
MW377.80 g/mol
LogP2.93
Rot. Bonds3

About 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide

2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide (PubChem CID 164587264) has the molecular formula C18H12ClN7O and a molecular weight of 377.80 g/mol. Its IUPAC name is 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide
PubChem CID164587264
Molecular FormulaC18H12ClN7O
Molecular Weight377.80 g/mol
Exact Mass377.08
IUPAC Name2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide
SMILESCn1cc(-n2ncc3ccc(NC(=O)c4cc(C#N)cnc4Cl)cc32)cn1
InChIInChI=1S/C18H12ClN7O/c1-25-10-14(9-22-25)26-16-5-13(3-2-12(16)8-23-26)24-18(27)15-4-11(6-20)7-21-17(15)19/h2-5,7-10H,1H3,(H,24,27)
InChIKeyTUOXUWSVDIKEPB-UHFFFAOYSA-N
XLogP2.93
TPSA101.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.80
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-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

Related Compounds

6-cyano-2-methyl-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide
CID 164587354
N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]-2-propan-2-ylbenzamide
CID 175755919
3-cyano-2,6-dimethyl-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]benzamide
CID 164587242
N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 175755920
2-chloro-5-fluoro-N-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 103891962
2-chloro-N-(4-cyanophenyl)-5-fluoropyridine-3-carboxamide
CID 103893052
3-cyano-2-propan-2-yl-N-(1-pyridazin-4-ylindazol-6-yl)benzamide
CID 164587334
2-chloro-5-cyanopyridine-3-carboxylic acid
CID 55219588
6-chloro-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine
CID 169489359
3-cyano-N-[1-(2-morpholin-4-yl-4-pyridinyl)indazol-6-yl]-2-propan-2-ylbenzamide
CID 164586856
(5S)-5-[[1-(1-methylpyrazol-4-yl)indazol-6-yl]amino]-1-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalene-2-carbonitrile
CID 164586702
8-[5-chloro-1-(1-methylpyrazol-4-yl)indazol-6-yl]oxy-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 172792472

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide?
The IUPAC name of 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide (CID 164587264) is 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide is Cn1cc(-n2ncc3ccc(NC(=O)c4cc(C#N)cnc4Cl)cc32)cn1.
What is the InChIKey of 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide?
The InChIKey is TUOXUWSVDIKEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClN7O/c1-25-10-14(9-22-25)26-16-5-13(3-2-12(16)8-23-26)24-18(27)15-4-11(6-20)7-21-17(15)19/h2-5,7-10H,1H3,(H,24,27).
What are the key properties of 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide?
2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide has a molecular weight of 377.80 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-cyano-N-[1-(1-methylpyrazol-4-yl)indazol-6-yl]pyridine-3-carboxamide is sourced from PubChem (CID 164587264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).